BIM-0029980.P001
TL;DR: BIM-0029980.P001 (CAS 63875-33-2) is a chemical compound with molecular formula C16H13N5O3S and molecular weight 355.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(2-nitrophenyl)methylideneamino]acetamide
Also Known As: BIM-0029980.P001, 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(2-nitrophenyl)methylideneamino]acetamide, N-[(1E)-2-(2-nitrophenyl)-1-azavinyl]-2-benzimidazol-2-ylthioacetamide, (E)-2-((1H-benzo[d]imidazol-2-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide, 2-(1H-benzimidazol-2-ylsulfanyl)-N'-[(E)-(2-nitrophenyl)methylidene]acetohydrazide
| Molecular Formula | C16H13N5O3S |
|---|---|
| Molecular Weight | 355.07 g/mol |
| LogP | 2.7135 |
| Topological Polar Surface Area | 113.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.0739 |
| Heavy Atoms | 25 |
| Complexity | 920.603 |
Chemical Identifiers
| CAS Number | 63875-33-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3N2)[N+](=O)[O-] |
Product Overview
BIM-0029980.P001 (CAS 63875-33-2), with molecular formula C16H13N5O3S and molecular weight 355.07 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(2-nitrophenyl)methylideneamino]acetamide.
Chemical Property Profile of BIM-0029980.P001
Property Insights of BIM-0029980.P001
The XLogP value of 2.7135 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0029980.P001. The TPSA of 113.28 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0029980.P001. Following Lipinski's Rule of Five, BIM-0029980.P001 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0029980.P001?
The CAS number of BIM-0029980.P001 is 63875-33-2.
What is the molecular formula of BIM-0029980.P001?
The molecular formula of BIM-0029980.P001 is C16H13N5O3S.
What is the molecular weight of BIM-0029980.P001?
The molecular weight of BIM-0029980.P001 is 355.07 g/mol.
Where can I buy BIM-0029980.P001?
You can request a quote for BIM-0029980.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0029980.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0029980.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.