2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide
TL;DR: 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide (CAS 123252-97-1) is a chemical compound with molecular formula C18H18ClN3O4S2 and molecular weight 439.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-methyl-4-(3-methylbut-2-enoxy)-1,1-dioxo-N-pyridin-2-ylthieno[2,3-e]thiazine-3-carboxamide
Also Known As: 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide, 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-buten-1-yl)oxy)-N-2-pyridinyl-, 1,1-dioxide, 6-chloro-2-methyl-4-(3-methylbut-2-enoxy)-1,1-dioxo-N-pyridin-2-ylthieno[2,3-e]thiazine-3-carboxamide, 6-Chloro-2-methyl-4-[(3-methylbut-2-en-1-yl)oxy]-1,1-dioxo-N-(pyridin-2-yl)-1,2-dihydro-1lambda~6~-thieno[2,3-e][1,2]thiazine-3-carboxamide, RefChem:1065364
| Molecular Formula | C18H18ClN3O4S2 |
|---|---|
| Molecular Weight | 439.04 g/mol |
| LogP | 3.7207 |
| Topological Polar Surface Area | 88.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.04272 |
| Heavy Atoms | 28 |
| Complexity | 1071.5052 |
Chemical Identifiers
| CAS Number | 123252-97-1 |
|---|---|
| SMILES | CC(=CCOC1=C(N(S(=O)(=O)C2=C1SC(=C2)Cl)C)C(=O)NC3=CC=CC=N3)C |
Product Overview
2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide (CAS 123252-97-1), with molecular formula C18H18ClN3O4S2 and molecular weight 439.04 g/mol. IUPAC: 6-chloro-2-methyl-4-(3-methylbut-2-enoxy)-1,1-dioxo-N-pyridin-2-ylthieno[2,3-e]thiazine-3-carboxamide.
Chemical Property Profile of 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide
Property Insights of 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide
The XLogP value of 3.7207 indicates that 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide. Following Lipinski's Rule of Five, 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide 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 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide?
The CAS number of 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide is 123252-97-1.
What is the molecular formula of 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide?
The molecular formula of 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide is C18H18ClN3O4S2.
What is the molecular weight of 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide?
The molecular weight of 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide is 439.04 g/mol.
Where can I buy 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide?
You can request a quote for 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-2-methyl-4-((3-methyl-2-butenyl)oxy)-N-(2-pyridinyl)-, 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.