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CAS 1027155-76-5 N-[4-(5-AMinobenziMidazol-2-yl)phenyl]benzaMide molecular structure lightbox
CAS RN: 1027155-76-5

N-[4-(5-AMinobenziMidazol-2-yl)phenyl]benzaMide

  • Product code: SSC-004041
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 5g, 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1027155-76-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 2 In Stock Shenzhen Inquiry
0.25g ≥95% 2 In Stock Beijing Inquiry
5g ≥95% 2 In Stock Shanghai Inquiry
1g ≥95% 1 In Stock Beijing Inquiry

1027155-76-5 / N-[4-(6-amino-1H-benzimidazol-2-yl)phenyl]benzamide

N-[4-(5-Aminobenzimidazol-2-yl)phenyl]benzamide | N-(4-(5-Amino-1H-benzo[d]imidazol-2-yl)phenyl)benzamide | N-[4-(6-amino-1H-benzimidazol-2-yl)phenyl]Benzamide

Standard CAS: 1027155-76-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1027155-76-5
Multi CAS
No
Molecular Formula
C20H16N4O
Molecular Weight
328.400000
Exact Mass
328.132411
SMILES
C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)N
InChI
InChI=1S/C20H16N4O/c21-15-8-11-17-18(12-15)24-19(23-17)13-6-9-16(10-7-13)22-20(25)14-4-2-1-3-5-14/h1-12H,21H2,(H,22,25)(H,23,24)
InChIKey
YZAJYGCOUNWNGD-UHFFFAOYSA-N
Synonyms
N-[4-(5-Aminobenzimidazol-2-yl)phenyl]benzamide N-(4-(5-Amino-1H-benzo[d]imidazol-2-yl)phenyl)benzamide N-[4-(6-amino-1H-benzimidazol-2-yl)phenyl]Benzamide MFCD18375244 Benzamide, N-[4-(6-amino-1H-benzimidazol-2-yl)phenyl]-

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
21
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
3
Molar refractivity
100.34
TPSA
83.8

LogP / Solubility

WLOGP
4.06
MLOGP
3.59
XLogP3
3.4
Consensus LogP
3.68
Log S (ESOL)
-4.86
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.19
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.53
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.84

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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