3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
TL;DR: 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide (CAS 440649-33-2) is a chemical compound with molecular formula C12H14N2O2S and molecular weight 250.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxo-N-propan-2-yl-4H-1,4-benzothiazine-6-carboxamide
Also Known As: 3-oxo-N-propan-2-yl-4H-1,4-benzothiazine-6-carboxamide, 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide, N-Isopropyl-3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-6-carboxamide, 9-oxo-N-propan-2-yl-7-thia-10-azabicyclo[4.4.0]deca-2,4,11-triene-3-carboxamide
| Molecular Formula | C12H14N2O2S |
|---|---|
| Molecular Weight | 250.08 g/mol |
| LogP | 1.869 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.0776 |
| Heavy Atoms | 17 |
| Complexity | 471.5735 |
Chemical Identifiers
| CAS Number | 440649-33-2 |
|---|---|
| SMILES | CC(C)NC(=O)C1=CC2=C(C=C1)SCC(=O)N2 |
Product Overview
3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide (CAS 440649-33-2), with molecular formula C12H14N2O2S and molecular weight 250.08 g/mol. IUPAC: 3-oxo-N-propan-2-yl-4H-1,4-benzothiazine-6-carboxamide.
Chemical Property Profile of 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Property Insights of 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
The XLogP value of 1.869 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide. With a topological polar surface area (TPSA) of 58.2 Ų, 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide has 2 hydrogen bond donor(s) and 3 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 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide?
The CAS number of 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide is 440649-33-2.
What is the molecular formula of 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide?
The molecular formula of 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide is C12H14N2O2S.
What is the molecular weight of 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide?
The molecular weight of 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide is 250.08 g/mol.
Where can I buy 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide?
You can request a quote for 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-oxo-N-(propan-2-yl)-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.