BAS 12272661
TL;DR: BAS 12272661 (CAS 876896-82-1) is a chemical compound with molecular formula C15H10ClN3O3S and molecular weight 347.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2,1,3-benzothiadiazol-4-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Also Known As: BAS 12272661, N-(5-chloro-2,1,3-benzothiadiazol-4-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide, AP-970/43204126
| Molecular Formula | C15H10ClN3O3S |
|---|---|
| Molecular Weight | 347.01 g/mol |
| LogP | 3.3682 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 347.01315 |
| Heavy Atoms | 23 |
| Complexity | 912.1185 |
Chemical Identifiers
| CAS Number | 876896-82-1 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C(=O)NC3=C(C=CC4=NSN=C43)Cl |
Product Overview
BAS 12272661 (CAS 876896-82-1), with molecular formula C15H10ClN3O3S and molecular weight 347.01 g/mol. IUPAC: N-(5-chloro-2,1,3-benzothiadiazol-4-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide.
Chemical Property Profile of BAS 12272661
Property Insights of BAS 12272661
The XLogP value of 3.3682 indicates that BAS 12272661 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.34 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12272661. Following Lipinski's Rule of Five, BAS 12272661 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 12272661?
The CAS number of BAS 12272661 is 876896-82-1.
What is the molecular formula of BAS 12272661?
The molecular formula of BAS 12272661 is C15H10ClN3O3S.
What is the molecular weight of BAS 12272661?
The molecular weight of BAS 12272661 is 347.01 g/mol.
Where can I buy BAS 12272661?
You can request a quote for BAS 12272661 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12272661?
Yes, KEHONG BIO provides custom synthesis services for BAS 12272661 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.