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CAS 305347-19-7 1H-Benzimidazole-2-methanol,1-(1-methylethyl)-(9CI) molecular structure lightbox
CAS RN: 305347-19-7

1H-Benzimidazole-2-methanol,1-(1-methylethyl)-(9CI)

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260516 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS305347-19-7
  • Purity/Analytical Methods: >99.0%
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305347-19-7 / (1-propan-2-ylbenzimidazol-2-yl)methanol

Standard CAS: 305347-19-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
305347-19-7
Multi CAS
No
Molecular Formula
C11H14N2O
Molecular Weight
190.240000
Exact Mass
190.110613
InChI
InChI=1S/C11H14N2O/c1-8(2)13-10-6-4-3-5-9(10)12-11(13)7-14/h3-6,8,14H,7H2,1-2H3
InChIKey
IJXQWUGHKOHMKR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
9
Fraction Csp3
0.36
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
56.04
TPSA
38.05

LogP / Solubility

WLOGP
2.11
MLOGP
1.86
XLogP3
1.3
Consensus LogP
1.76
Log S (ESOL)
-2.69
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.64
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.89
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.38

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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