BAS 01177289
TL;DR: BAS 01177289 (CAS 306951-22-4) is a chemical compound with molecular formula C31H28N4O3S and molecular weight 536.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-benzylbenzimidazol-2-yl)sulfanyl-N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]acetamide
Also Known As: BAS 01177289, 2-[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]-N'-{(E)-[3-(benzyloxy)-4-methoxyphenyl]methylidene}acetohydrazide, (E)-2-((1-benzyl-1H-benzo[d]imidazol-2-yl)thio)-N'-(3-(benzyloxy)-4-methoxybenzylidene)acetohydrazide, N-{(1E)-2-[4-methoxy-3-(phenylmethoxy)phenyl]-1-azavinyl}-2-[1-benzylbenzimida zol-2-ylthio]acetamide
| Molecular Formula | C31H28N4O3S |
|---|---|
| Molecular Weight | 536.19 g/mol |
| LogP | 5.9146 |
| Topological Polar Surface Area | 77.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 536.18823 |
| Heavy Atoms | 39 |
| Complexity | 1569.4033 |
Chemical Identifiers
| CAS Number | 306951-22-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3N2CC4=CC=CC=C4)OCC5=CC=CC=C5 |
Product Overview
BAS 01177289 (CAS 306951-22-4), with molecular formula C31H28N4O3S and molecular weight 536.19 g/mol. IUPAC: 2-(1-benzylbenzimidazol-2-yl)sulfanyl-N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]acetamide.
Chemical Property Profile of BAS 01177289
Property Insights of BAS 01177289
The XLogP value of 5.9146 indicates that BAS 01177289 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.74 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01177289. Following Lipinski's Rule of Five, BAS 01177289 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01177289?
The CAS number of BAS 01177289 is 306951-22-4.
What is the molecular formula of BAS 01177289?
The molecular formula of BAS 01177289 is C31H28N4O3S.
What is the molecular weight of BAS 01177289?
The molecular weight of BAS 01177289 is 536.19 g/mol.
Where can I buy BAS 01177289?
You can request a quote for BAS 01177289 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01177289?
Yes, KEHONG BIO provides custom synthesis services for BAS 01177289 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.