BAS 05436683
TL;DR: BAS 05436683 (CAS 685118-13-2) is a chemical compound with molecular formula C21H29N3O4S and molecular weight 419.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-hydroxy-3-(4-methylpiperazin-1-yl)propyl]-N-(2-methoxyphenyl)benzenesulfonamide
Also Known As: BAS 05436683, F1407-0008, N-[2-hydroxy-3-(4-methylpiperazin-1-yl)propyl]-N-(2-methoxyphenyl)benzenesulfonamide, N-(2-hydroxy-3-(4-methylpiperazin-1-yl)propyl)-N-(2-methoxyphenyl)benzenesulfonamide, {[2-hydroxy-3-(4-methyl-1-piperazinyl)propyl](o-methoxyphenyl)amino}(oxo)(phenyl)-lambda-sulfaniumolate
| Molecular Formula | C21H29N3O4S |
|---|---|
| Molecular Weight | 419.19 g/mol |
| LogP | 1.4988 |
| Topological Polar Surface Area | 73.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 419.18787 |
| Heavy Atoms | 29 |
| Complexity | 883.809 |
Chemical Identifiers
| CAS Number | 685118-13-2 |
|---|---|
| SMILES | CN1CCN(CC1)CC(CN(C2=CC=CC=C2OC)S(=O)(=O)C3=CC=CC=C3)O |
Product Overview
BAS 05436683 (CAS 685118-13-2), with molecular formula C21H29N3O4S and molecular weight 419.19 g/mol. IUPAC: N-[2-hydroxy-3-(4-methylpiperazin-1-yl)propyl]-N-(2-methoxyphenyl)benzenesulfonamide.
Chemical Property Profile of BAS 05436683
Property Insights of BAS 05436683
The XLogP value of 1.4988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 05436683. The TPSA of 73.32 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05436683. Following Lipinski's Rule of Five, BAS 05436683 has 1 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 BAS 05436683?
The CAS number of BAS 05436683 is 685118-13-2.
What is the molecular formula of BAS 05436683?
The molecular formula of BAS 05436683 is C21H29N3O4S.
What is the molecular weight of BAS 05436683?
The molecular weight of BAS 05436683 is 419.19 g/mol.
Where can I buy BAS 05436683?
You can request a quote for BAS 05436683 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05436683?
Yes, KEHONG BIO provides custom synthesis services for BAS 05436683 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.