CAS RN: 719285-67-3
N-(1H-BENZOIMIDAZOL-2-YL)-BENZENE-1,2-DIAMINE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250331 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS719285-67-3
- Purity/Analytical Methods: >99.0%
719285-67-3 / 2-N-(1H-benzimidazol-2-yl)benzene-1,2-diamine
Basic Information
CAS
719285-67-3
Multi CAS
No
Molecular Formula
C13H12N4
Molecular Weight
224.260000
Exact Mass
224.106196
InChI
InChI=1S/C13H12N4/c14-9-5-1-2-6-10(9)15-13-16-11-7-3-4-8-12(11)17-13/h1-8H,14H2,(H2,15,16,17)
InChIKey
ZZDGNBWCSPZNRU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
15
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
3
Molar refractivity
70.23
TPSA
66.73
LogP / Solubility
WLOGP
2.89
MLOGP
2.54
XLogP3
2.7
Consensus LogP
2.71
Log S (ESOL)
-3.57
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.48
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.76
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)
-2.04
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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