A2970/0125131
TL;DR: A2970/0125131 (CAS 522637-45-2) is a chemical compound with molecular formula C23H21N3O3S2 and molecular weight 451.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyphenyl)imino-4-oxo-N-phenyl-3-(thiophen-2-ylmethyl)-1,3-thiazinane-6-carboxamide
Also Known As: A2970/0125131, (2Z)-2-[(4-methoxyphenyl)imino]-4-oxo-N-phenyl-3-(thiophen-2-ylmethyl)-1,3-thiazinane-6-carboxamide, (Z)-2-((4-methoxyphenyl)imino)-4-oxo-N-phenyl-3-(thiophen-2-ylmethyl)-1,3-thiazinane-6-carboxamide, (2Z)-2-[(4-METHOXYPHENYL)IMINO]-4-OXO-N-PHENYL-3-[(THIOPHEN-2-YL)METHYL]-1,3-THIAZINANE-6-CARBOXAMIDE, 2-(4-methoxyphenyl)imino-4-oxo-N-phenyl-3-(thiophen-2-ylmethyl)-1,3-thiazinane-6-carboxamide
| Molecular Formula | C23H21N3O3S2 |
|---|---|
| Molecular Weight | 451.10 g/mol |
| LogP | 4.9172 |
| Topological Polar Surface Area | 71.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.10245 |
| Heavy Atoms | 31 |
| Complexity | 1067.2157 |
Chemical Identifiers
| CAS Number | 522637-45-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N=C2N(C(=O)CC(S2)C(=O)NC3=CC=CC=C3)CC4=CC=CS4 |
Product Overview
A2970/0125131 (CAS 522637-45-2), with molecular formula C23H21N3O3S2 and molecular weight 451.10 g/mol. IUPAC: 2-(4-methoxyphenyl)imino-4-oxo-N-phenyl-3-(thiophen-2-ylmethyl)-1,3-thiazinane-6-carboxamide.
Chemical Property Profile of A2970/0125131
Property Insights of A2970/0125131
The XLogP value of 4.9172 indicates that A2970/0125131 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A2970/0125131. Following Lipinski's Rule of Five, A2970/0125131 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 A2970/0125131?
The CAS number of A2970/0125131 is 522637-45-2.
What is the molecular formula of A2970/0125131?
The molecular formula of A2970/0125131 is C23H21N3O3S2.
What is the molecular weight of A2970/0125131?
The molecular weight of A2970/0125131 is 451.10 g/mol.
Where can I buy A2970/0125131?
You can request a quote for A2970/0125131 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2970/0125131?
Yes, KEHONG BIO provides custom synthesis services for A2970/0125131 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.