Home Cart 0 Sign in  
X

[ CAS No. 2383588-60-9 ]

{[proInfo.proName]} ,{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]}
3d Animation Molecule Structure of 2383588-60-9
Chemical Structure| 2383588-60-9
Chemical Structure| 2383588-60-9
Structure of 2383588-60-9 * Storage: {[proInfo.prStorage]}
Cart0 Add to My Favorites Bulk Inquiry Add To Cart

Quality Control of [ 2383588-60-9 ]

Related Doc. of [ 2383588-60-9 ]

Alternatived Products of [ 2383588-60-9 ]

Product Details of [ 2383588-60-9 ]

CAS No. :2383588-60-9 MDL No. :N/A
Formula : C6H2BrClI2 Boiling Point : -
Linear Structure Formula :- InChI Key :WINOSSPCPSBARO-UHFFFAOYSA-N
M.W :443.25 Pubchem ID :143626045
Synonyms :

Calculated chemistry of [ 2383588-60-9 ]

Physicochemical Properties

Num. heavy atoms : 10
Num. arom. heavy atoms : 6
Fraction Csp3 : 0.0
Num. rotatable bonds : 0
Num. H-bond acceptors : 0.0
Num. H-bond donors : 0.0
Molar Refractivity : 64.59
TPSA : 0.0 Ų

Pharmacokinetics

GI absorption : Low
BBB permeant : Yes
P-gp substrate : No
CYP1A2 inhibitor : Yes
CYP2C19 inhibitor : No
CYP2C9 inhibitor : Yes
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -5.78 cm/s

Lipophilicity

Log Po/w (iLOGP) : 2.73
Log Po/w (XLOGP3) : 4.54
Log Po/w (WLOGP) : 4.31
Log Po/w (MLOGP) : 5.34
Log Po/w (SILICOS-IT) : 5.11
Consensus Log Po/w : 4.41

Druglikeness

Lipinski : 1.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 1.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -5.89
Solubility : 0.000568 mg/ml ; 0.00000128 mol/l
Class : Moderately soluble
Log S (Ali) : -4.26
Solubility : 0.0242 mg/ml ; 0.0000547 mol/l
Class : Moderately soluble
Log S (SILICOS-IT) : -5.65
Solubility : 0.000999 mg/ml ; 0.00000225 mol/l
Class : Moderately soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 3.0 alert
Leadlikeness : 2.0
Synthetic accessibility : 2.32

Safety of [ 2383588-60-9 ]

Signal Word:Warning Class:
Precautionary Statements:P261-P301+P312-P302+P352-P304+P340-P305+P351+P338 UN#:
Hazard Statements:H302-H315-H319-H335 Packing Group:
GHS Pictogram:
Same Skeleton Products
Historical Records