BAS 03111778
TL;DR: BAS 03111778 (CAS 431892-77-2) is a chemical compound with molecular formula C25H27N3O4S and molecular weight 465.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-hydroxy-3-(2-methylbenzimidazol-1-yl)propyl]-N-(2-methoxyphenyl)-4-methylbenzenesulfonamide
Also Known As: BAS 03111778, N-[2-hydroxy-3-(2-methylbenzimidazol-1-yl)propyl]-N-(2-methoxyphenyl)-4-methylbenzenesulfonamide, N-(2-hydroxy-3-(2-methyl-1H-benzo[d]imidazol-1-yl)propyl)-N-(2-methoxyphenyl)-4-methylbenzenesulfonamide, N-[2-hydroxy-3-(2-methyl-1H-benzimidazol-1-yl)propyl]-N-(2-methoxyphenyl)-4-methylbenzenesulfonamide
| Molecular Formula | C25H27N3O4S |
|---|---|
| Molecular Weight | 465.17 g/mol |
| LogP | 3.91814 |
| Topological Polar Surface Area | 84.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 465.17224 |
| Heavy Atoms | 33 |
| Complexity | 1364.1934 |
Chemical Identifiers
| CAS Number | 431892-77-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN2C(=NC3=CC=CC=C32)C)O)C4=CC=CC=C4OC |
Product Overview
BAS 03111778 (CAS 431892-77-2), with molecular formula C25H27N3O4S and molecular weight 465.17 g/mol. IUPAC: N-[2-hydroxy-3-(2-methylbenzimidazol-1-yl)propyl]-N-(2-methoxyphenyl)-4-methylbenzenesulfonamide.
Chemical Property Profile of BAS 03111778
Property Insights of BAS 03111778
The XLogP value of 3.91814 indicates that BAS 03111778 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.66 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03111778. Following Lipinski's Rule of Five, BAS 03111778 has 1 hydrogen bond donor(s) and 5 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 BAS 03111778?
The CAS number of BAS 03111778 is 431892-77-2.
What is the molecular formula of BAS 03111778?
The molecular formula of BAS 03111778 is C25H27N3O4S.
What is the molecular weight of BAS 03111778?
The molecular weight of BAS 03111778 is 465.17 g/mol.
Where can I buy BAS 03111778?
You can request a quote for BAS 03111778 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03111778?
Yes, KEHONG BIO provides custom synthesis services for BAS 03111778 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.