2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester
TL;DR: 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester (CAS 82140-66-7) is a chemical compound with molecular formula C15H19N3O3S and molecular weight 321.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-butylimino-3,7-dimethyl-4-oxopyrido[3,2-e][1,3]thiazine-5-carboxylate
Also Known As: 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester, methyl 2-butylimino-3,7-dimethyl-4-oxopyrido[3,2-e][1,3]thiazine-5-carboxylate, 2-(Butylimino)-3,4-dihydro-3,7-dimethyl-4-oxo-2H-pyrido[3,2-e][1,3]thiazine-5-carboxylic acid methyl ester, methyl 2-(butylimino)-3,7-dimethyl-4-oxo-2H,3H,4H-pyrido[3,2-e][1,3]thiazine-5-carboxylate
| Molecular Formula | C15H19N3O3S |
|---|---|
| Molecular Weight | 321.11 g/mol |
| LogP | 1.79082 |
| Topological Polar Surface Area | 73.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.11472 |
| Heavy Atoms | 22 |
| Complexity | 836.26715 |
Chemical Identifiers
| CAS Number | 82140-66-7 |
|---|---|
| SMILES | CCCCN=C1N(C(=O)C2=C(C=C(N=C2S1)C)C(=O)OC)C |
Product Overview
2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester (CAS 82140-66-7), with molecular formula C15H19N3O3S and molecular weight 321.11 g/mol. IUPAC: methyl 2-butylimino-3,7-dimethyl-4-oxopyrido[3,2-e][1,3]thiazine-5-carboxylate.
Chemical Property Profile of 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester
Property Insights of 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester
The XLogP value of 1.79082 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester. The TPSA of 73.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester. Following Lipinski's Rule of Five, 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester has 0 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 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester?
The CAS number of 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester is 82140-66-7.
What is the molecular formula of 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester?
The molecular formula of 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester is C15H19N3O3S.
What is the molecular weight of 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester?
The molecular weight of 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester is 321.11 g/mol.
Where can I buy 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester?
You can request a quote for 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2H-Pyrido(3,2-e)(1,3)thiazine-5-carboxylic acid, 3,4-dihydro-2-(butylimino)-3,7-dimethyl-4-oxo-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.