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CAS 71002-88-5 4-(5-nitro-H-benzimidazol-2-yl)aniline molecular structure lightbox
CAS RN: 71002-88-5

4-(5-nitro-H-benzimidazol-2-yl)aniline

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250925 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-180696
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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: 0.25g, 0.1g, 1g, 5g
  • Available purity: >97%
  • 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 71002-88-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g >97% 3 In Stock Beijing Inquiry
0.1g >97% 2 In Stock Hong Kong Inquiry
1g >97% 2 In Stock Beijing Inquiry
5g >97% 1 In Stock Hong Kong Inquiry

71002-88-5 / 4-(6-nitro-1H-benzimidazol-2-yl)aniline

Standard CAS: 71002-88-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
71002-88-5
Multi CAS
Yes
Molecular Formula
C13H10N4O2
Molecular Weight
254.240000
Exact Mass
254.080376
InChI
InChI=1S/C13H10N4O2/c14-9-3-1-8(2-4-9)13-15-11-6-5-10(17(18)19)7-12(11)16-13/h1-7H,14H2,(H,15,16)
InChIKey
VQAXRPAGHNBDHU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
15
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
72.6
TPSA
97.84

LogP / Solubility

WLOGP
2.72
MLOGP
2.4
XLogP3
2.7
Consensus LogP
2.61
Log S (ESOL)
-3.58
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.61
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.81
Class (SILICOS-IT)
Poorly 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)
-2.34

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

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