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CAS 7146-97-6 1H-Benzimidazole,2-(methoxymethyl)-(9CI) molecular structure lightbox
CAS RN: 7146-97-6

1H-Benzimidazole,2-(methoxymethyl)-(9CI)

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251209 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS7146-97-6
  • Purity/Analytical Methods: >99.0%
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7146-97-6 / 2-(methoxymethyl)-1H-benzimidazole

Standard CAS: 7146-97-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
7146-97-6
Multi CAS
Yes
Molecular Formula
C9H10N2O
Molecular Weight
162.190000
Exact Mass
162.079313
InChI
InChI=1S/C9H10N2O/c1-12-6-9-10-7-4-2-3-5-8(7)11-9/h2-5H,6H2,1H3,(H,10,11)
InChIKey
PHBCKTTUXIONFQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
9
Fraction Csp3
0.22
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
46.81
TPSA
37.91

LogP / Solubility

WLOGP
1.71
MLOGP
1.5
XLogP3
1.4
Consensus LogP
1.54
Log S (ESOL)
-2.35
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.12
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.37
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)
-2.5

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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