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CAS 176161-24-3 BENZIMIDAVIR molecular structure lightbox
CAS RN: 176161-24-3

BENZIMIDAVIR

Product Availability

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9 package records9 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250703 100mg In stock Shanghai Inquiry
Batchno.20250508 10mg In stock Shanghai Inquiry
Batchno.20260121 1g In stock Shanghai Inquiry
Batchno.20260112 1mg In stock Shanghai Inquiry
Batchno.20250531 250mg In stock Shanghai Inquiry
Batchno.20250618 25mg In stock Shanghai Inquiry
Batchno.20251008 50mg In stock Shanghai Inquiry
Batchno.20260123 5mg In stock Shanghai Inquiry
Batchno.20250930 5mg / 10mg / 50mg / 200mg Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-077197
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 176161-24-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

176161-24-3 / (2S,3S,4R,5S)-2-[5,6-dichloro-2-(propan-2-ylamino)benzimidazol-1-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Standard CAS: 176161-24-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
176161-24-3
Multi CAS
No
Molecular Formula
C15H19Cl2N3O4
Molecular Weight
376.200000
Exact Mass
375.075262
SMILES
CC(C)NC1=NC2=CC(=C(C=C2N1[C@@H]3[C@H]([C@H]([C@@H](O3)CO)O)O)Cl)Cl
InChI
InChI=1S/C15H19Cl2N3O4/c1-6(2)18-15-19-9-3-7(16)8(17)4-10(9)20(15)14-13(23)12(22)11(5-21)24-14/h3-4,6,11-14,21-23H,5H2,1-2H3,(H,18,19)/t11-,12-,13-,14-/m0/s1
InChIKey
KJFBVJALEQWJBS-XUXIUFHCSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
9
Fraction Csp3
0.53
Rotatable bonds
4
H-bond acceptors
7
H-bond donors
4
Molar refractivity
91.52
TPSA
99.77

LogP / Solubility

WLOGP
1.77
MLOGP
1.58
XLogP3
2.2
Consensus LogP
1.85
Log S (ESOL)
-3.3
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.93
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.06
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.75

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5

Safety & Transport

Pictogram(s)
Corrosive Irritant Health Hazard
Signal
Danger
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H371 (50%): May cause damage to organs [Warning Specific target organ toxicity, single exposure]
Precautionary Statement Codes
P260, P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P308+P316, P317, P330, P405, and P501

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