6-chloro-3,4-dihydro-2H-1,4-benzothiazine
TL;DR: 6-chloro-3,4-dihydro-2H-1,4-benzothiazine (CAS 89979-18-0) is a chemical compound with molecular formula C8H8ClNS and molecular weight 185.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3,4-dihydro-2H-1,4-benzothiazine
Also Known As: 6-chloro-3,4-dihydro-2H-1,4-benzothiazine, 6-CHLORO-3,4-DIHYDRO-2H-BENZO[B][1,4]THIAZINE, 6-Chloro-3,4-dihydro-2H-1,4-benzothiazine, AldrichCPR, 854-723-9, RefChem:541588
| Molecular Formula | C8H8ClNS |
|---|---|
| Molecular Weight | 185.01 g/mol |
| LogP | 2.8576 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 185.00659 |
| Heavy Atoms | 11 |
| Complexity | 274.79462 |
Chemical Identifiers
| CAS Number | 89979-18-0 |
|---|---|
| SMILES | C1CSC2=C(N1)C=C(C=C2)Cl |
Product Overview
6-chloro-3,4-dihydro-2H-1,4-benzothiazine (CAS 89979-18-0), with molecular formula C8H8ClNS and molecular weight 185.01 g/mol. IUPAC: 6-chloro-3,4-dihydro-2H-1,4-benzothiazine.
Chemical Property Profile of 6-chloro-3,4-dihydro-2H-1,4-benzothiazine
Property Insights of 6-chloro-3,4-dihydro-2H-1,4-benzothiazine
The XLogP value of 2.8576 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-chloro-3,4-dihydro-2H-1,4-benzothiazine. With a topological polar surface area (TPSA) of 12.03 Ų, 6-chloro-3,4-dihydro-2H-1,4-benzothiazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-3,4-dihydro-2H-1,4-benzothiazine has 1 hydrogen bond donor(s) and 2 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 6-chloro-3,4-dihydro-2H-1,4-benzothiazine?
The CAS number of 6-chloro-3,4-dihydro-2H-1,4-benzothiazine is 89979-18-0.
What is the molecular formula of 6-chloro-3,4-dihydro-2H-1,4-benzothiazine?
The molecular formula of 6-chloro-3,4-dihydro-2H-1,4-benzothiazine is C8H8ClNS.
What is the molecular weight of 6-chloro-3,4-dihydro-2H-1,4-benzothiazine?
The molecular weight of 6-chloro-3,4-dihydro-2H-1,4-benzothiazine is 185.01 g/mol.
Where can I buy 6-chloro-3,4-dihydro-2H-1,4-benzothiazine?
You can request a quote for 6-chloro-3,4-dihydro-2H-1,4-benzothiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-3,4-dihydro-2H-1,4-benzothiazine?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-3,4-dihydro-2H-1,4-benzothiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.