CAS RN: 6266-09-7

2-(2-HYDROXYPHENYL)-5-METHYL-1H-BENZOIMIDAZOLE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250422 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS6266-09-7
  • Purity/Analytical Methods: >99.0%
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6266-09-7 / 2-(6-methyl-1H-benzimidazol-2-yl)phenol

Standard CAS: 6266-09-7 Multi CAS: No

Basic Information

CAS
6266-09-7
Multi CAS
No
Molecular Formula
C14H12N2O
Molecular Weight
224.260000
Exact Mass
224.094963
InChI
InChI=1S/C14H12N2O/c1-9-6-7-11-12(8-9)16-14(15-11)10-4-2-3-5-13(10)17/h2-8,17H,1H3,(H,15,16)
InChIKey
RENIIFGMUKZWHA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
15
Fraction Csp3
0.07
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
67.93
TPSA
48.91

LogP / Solubility

WLOGP
3.24
MLOGP
2.86
XLogP3
3.2
Consensus LogP
3.1
Log S (ESOL)
-3.86
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.74
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.93
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.78

Drug-likeness / Medicinal Chemistry

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

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