F2002-0431
TL;DR: F2002-0431 (CAS 872986-17-9) is a chemical compound with molecular formula C20H25N3O6S2 and molecular weight 467.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(4-methoxy-3-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N'-(thiophen-2-ylmethyl)oxamide
Also Known As: F2002-0431, N'-{[3-(4-methoxy-3-methylbenzenesulfonyl)-1,3-oxazinan-2-yl]methyl}-N-[(thiophen-2-yl)methyl]ethanediamide, N-[[3-(4-methoxy-3-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N'-(thiophen-2-ylmethyl)oxamide, N1-((3-((4-methoxy-3-methylphenyl)sulfonyl)-1,3-oxazinan-2-yl)methyl)-N2-(thiophen-2-ylmethyl)oxalamide
| Molecular Formula | C20H25N3O6S2 |
|---|---|
| Molecular Weight | 467.12 g/mol |
| LogP | 1.23482 |
| Topological Polar Surface Area | 114.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 467.11847 |
| Heavy Atoms | 31 |
| Complexity | 1023.5411 |
Chemical Identifiers
| CAS Number | 872986-17-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)N2CCCOC2CNC(=O)C(=O)NCC3=CC=CS3)OC |
Product Overview
F2002-0431 (CAS 872986-17-9), with molecular formula C20H25N3O6S2 and molecular weight 467.12 g/mol. IUPAC: N-[[3-(4-methoxy-3-methylphenyl)sulfonyl-1,3-oxazinan-2-yl]methyl]-N'-(thiophen-2-ylmethyl)oxamide.
Chemical Property Profile of F2002-0431
Property Insights of F2002-0431
The XLogP value of 1.23482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2002-0431. The TPSA of 114.04 Ų falls within the moderate polarity range, balancing permeability and solubility for F2002-0431. Following Lipinski's Rule of Five, F2002-0431 has 2 hydrogen bond donor(s) and 7 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 F2002-0431?
The CAS number of F2002-0431 is 872986-17-9.
What is the molecular formula of F2002-0431?
The molecular formula of F2002-0431 is C20H25N3O6S2.
What is the molecular weight of F2002-0431?
The molecular weight of F2002-0431 is 467.12 g/mol.
Where can I buy F2002-0431?
You can request a quote for F2002-0431 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2002-0431?
Yes, KEHONG BIO provides custom synthesis services for F2002-0431 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.