Purity | Size | Price | VIP Price | USA Stock *0-1 Day | Global Stock *5-7 Days | Quantity | |||||
{[ item.p_purity ]} | {[ item.pr_size ]} |
{[ getRatePrice(item.pr_usd, 1,1) ]} {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} |
{[ getRatePrice(item.pr_usd, 1,1) ]} | Inquiry {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} {[ getRatePrice(item.pr_usd,1,item.mem_rate) ]} | {[ item.pr_usastock ]} | Inquiry - | {[ item.pr_chinastock ]} | Inquiry - |
* Storage: {[proInfo.prStorage]}
CAS No. : | 73221-20-2 | MDL No. : | MFCD11976231 |
Formula : | C9H5F3N2O2 | Boiling Point : | - |
Linear Structure Formula : | - | InChI Key : | LSCPGFRSWFYTPL-UHFFFAOYSA-N |
M.W : | 230.14 | Pubchem ID : | 56763812 |
Synonyms : |
|
Num. heavy atoms : | 16 |
Num. arom. heavy atoms : | 9 |
Fraction Csp3 : | 0.11 |
Num. rotatable bonds : | 2 |
Num. H-bond acceptors : | 6.0 |
Num. H-bond donors : | 1.0 |
Molar Refractivity : | 47.15 |
TPSA : | 54.6 Ų |
GI absorption : | High |
BBB permeant : | Yes |
P-gp substrate : | No |
CYP1A2 inhibitor : | No |
CYP2C19 inhibitor : | No |
CYP2C9 inhibitor : | No |
CYP2D6 inhibitor : | No |
CYP3A4 inhibitor : | No |
Log Kp (skin permeation) : | -6.13 cm/s |
Log Po/w (iLOGP) : | 1.42 |
Log Po/w (XLOGP3) : | 2.21 |
Log Po/w (WLOGP) : | 3.2 |
Log Po/w (MLOGP) : | 1.35 |
Log Po/w (SILICOS-IT) : | 1.29 |
Consensus Log Po/w : | 1.9 |
Lipinski : | 0.0 |
Ghose : | None |
Veber : | 0.0 |
Egan : | 0.0 |
Muegge : | 0.0 |
Bioavailability Score : | 0.56 |
Log S (ESOL) : | -2.94 |
Solubility : | 0.262 mg/ml ; 0.00114 mol/l |
Class : | Soluble |
Log S (Ali) : | -2.99 |
Solubility : | 0.235 mg/ml ; 0.00102 mol/l |
Class : | Soluble |
Log S (SILICOS-IT) : | -2.35 |
Solubility : | 1.02 mg/ml ; 0.00444 mol/l |
Class : | Soluble |
PAINS : | 0.0 alert |
Brenk : | 0.0 alert |
Leadlikeness : | 1.0 |
Synthetic accessibility : | 1.79 |
Signal Word: | Warning | Class: | N/A |
Precautionary Statements: | P261-P305+P351+P338 | UN#: | N/A |
Hazard Statements: | H302-H315-H319-H335 | Packing Group: | N/A |
GHS Pictogram: |
* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.
[ 1260798-62-6 ]
5-(Trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
Similarity: 0.71
[ 33469-36-2 ]
2-Phenyl-4-(trifluoromethyl)-1H-imidazole
Similarity: 0.70
[ 1620569-19-8 ]
7-(Trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
Similarity: 0.69
[ 1260885-46-8 ]
Ethyl 5-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate
Similarity: 0.68
[ 886363-98-0 ]
7-Fluoroimidazo[1,2-a]pyridine-2-carboxylic acid
Similarity: 0.65
[ 133427-08-4 ]
Imidazo[1,2-a]pyridine-8-carboxylic acid
Similarity: 0.81
[ 155735-02-7 ]
6-Chloroimidazo[1,2-a]pyridine-8-carboxylic acid
Similarity: 0.77
[ 903129-78-2 ]
6-Bromoimidazo[1,2-a]pyridine-8-carboxylic acid
Similarity: 0.76
[ 1260798-62-6 ]
5-(Trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
Similarity: 0.71
[ 88751-05-7 ]
8-Methylimidazo[1,2-a]pyridine-2-carboxylic acid
Similarity: 0.71
[ 1260798-62-6 ]
5-(Trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
Similarity: 0.71
[ 33469-36-2 ]
2-Phenyl-4-(trifluoromethyl)-1H-imidazole
Similarity: 0.70
[ 1620569-19-8 ]
7-(Trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
Similarity: 0.69
[ 1260885-46-8 ]
Ethyl 5-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate
Similarity: 0.68
[ 641571-13-3 ]
3-(4-Methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)benzoic acid
Similarity: 0.64
[ 133427-08-4 ]
Imidazo[1,2-a]pyridine-8-carboxylic acid
Similarity: 0.81
[ 155735-02-7 ]
6-Chloroimidazo[1,2-a]pyridine-8-carboxylic acid
Similarity: 0.77
[ 133427-07-3 ]
Methyl imidazo[1,2-a]pyridine-8-carboxylate
Similarity: 0.77
[ 903129-78-2 ]
6-Bromoimidazo[1,2-a]pyridine-8-carboxylic acid
Similarity: 0.76
[ 760144-55-6 ]
Methyl 6-chloroimidazo[1,2-a]pyridine-8-carboxylate
Similarity: 0.73