BAS 05346812
TL;DR: BAS 05346812 (CAS 674339-16-3) is a chemical compound with molecular formula C17H17ClN4O3S2 and molecular weight 424.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5-chloro-2-hydroxyphenyl)methylamino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
Also Known As: BAS 05346812, 4-((5-chloro-2-hydroxybenzyl)amino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide, 4-(5-Chloro-2-hydroxy-benzylamino)-N-(5-ethyl-[1,3,4]thiadiazol-2-yl)-benzenesulfonamide, 4-[(5-chloro-2-hydroxybenzyl)amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide, 4-[(5-chloro-2-hydroxybenzyl)amino]-N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]benzenesulfonamide
| Molecular Formula | C17H17ClN4O3S2 |
|---|---|
| Molecular Weight | 424.04 g/mol |
| LogP | 3.8724 |
| Topological Polar Surface Area | 104.21 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.04306 |
| Heavy Atoms | 27 |
| Complexity | 1036.587 |
Chemical Identifiers
| CAS Number | 674339-16-3 |
|---|---|
| SMILES | CCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NCC3=C(C=CC(=C3)Cl)O |
Product Overview
BAS 05346812 (CAS 674339-16-3), with molecular formula C17H17ClN4O3S2 and molecular weight 424.04 g/mol. IUPAC: 4-[(5-chloro-2-hydroxyphenyl)methylamino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide.
Chemical Property Profile of BAS 05346812
Property Insights of BAS 05346812
The XLogP value of 3.8724 indicates that BAS 05346812 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.21 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05346812. Following Lipinski's Rule of Five, BAS 05346812 has 3 hydrogen bond donor(s) and 7 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 05346812?
The CAS number of BAS 05346812 is 674339-16-3.
What is the molecular formula of BAS 05346812?
The molecular formula of BAS 05346812 is C17H17ClN4O3S2.
What is the molecular weight of BAS 05346812?
The molecular weight of BAS 05346812 is 424.04 g/mol.
Where can I buy BAS 05346812?
You can request a quote for BAS 05346812 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05346812?
Yes, KEHONG BIO provides custom synthesis services for BAS 05346812 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.