2H-1,4-Benzothiazin-3(4H)-one, 2-propyl-
TL;DR: 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl- (CAS 91132-38-6) is a chemical compound with molecular formula C11H13NOS and molecular weight 207.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propyl-4H-1,4-benzothiazin-3-one
Also Known As: 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl-, 2-propyl-4H-1,4-benzothiazin-3-one, 2-propyl-2H-1,4-benzothiazin-3(4H)-one, 2-propyl-4H-benzo[1,4]thiazin-3-one, 2-Propyl-2H-1,4-benzothiazine-3(4H)-one
| Molecular Formula | C11H13NOS |
|---|---|
| Molecular Weight | 207.07 g/mol |
| LogP | 2.8995 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.0718 |
| Heavy Atoms | 14 |
| Complexity | 350.8957 |
Chemical Identifiers
| CAS Number | 91132-38-6 |
|---|---|
| SMILES | CCCC1C(=O)NC2=CC=CC=C2S1 |
Product Overview
2H-1,4-Benzothiazin-3(4H)-one, 2-propyl- (CAS 91132-38-6), with molecular formula C11H13NOS and molecular weight 207.07 g/mol. IUPAC: 2-propyl-4H-1,4-benzothiazin-3-one.
Chemical Property Profile of 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl-
Property Insights of 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl-
The XLogP value of 2.8995 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl-. With a topological polar surface area (TPSA) of 29.1 Ų, 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl- 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 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl-?
The CAS number of 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl- is 91132-38-6.
What is the molecular formula of 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl-?
The molecular formula of 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl- is C11H13NOS.
What is the molecular weight of 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl-?
The molecular weight of 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl- is 207.07 g/mol.
Where can I buy 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl-?
You can request a quote for 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,4-Benzothiazin-3(4H)-one, 2-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.