2P-504S
TL;DR: 2P-504S (CAS 477887-57-3) is a chemical compound with molecular formula C20H17ClN2O5S3 and molecular weight 496.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[2-[2-[(2-chlorophenyl)sulfonylamino]phenyl]sulfanylacetyl]amino]thiophene-2-carboxylate
Also Known As: 2P-504S, methyl 3-({2-[(2-{[(2-chlorophenyl)sulfonyl]amino}phenyl)sulfanyl]acetyl}amino)-2-thiophenecarboxylate, methyl 3-[[2-[2-[(2-chlorophenyl)sulfonylamino]phenyl]sulfanylacetyl]amino]thiophene-2-carboxylate, methyl 3-(2-{[2-(2-chlorobenzenesulfonamido)phenyl]sulfanyl}acetamido)thiophene-2-carboxylate, methyl3-(2-{[2-(2-chlorobenzenesulfonamido)phenyl]sulfanyl}acetamido)thiophene-2-carboxylate
| Molecular Formula | C20H17ClN2O5S3 |
|---|---|
| Molecular Weight | 496.00 g/mol |
| LogP | 4.7197 |
| Topological Polar Surface Area | 101.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 495.9988 |
| Heavy Atoms | 31 |
| Complexity | 1210.7842 |
Chemical Identifiers
| CAS Number | 477887-57-3 |
|---|---|
| SMILES | COC(=O)C1=C(C=CS1)NC(=O)CSC2=CC=CC=C2NS(=O)(=O)C3=CC=CC=C3Cl |
Product Overview
2P-504S (CAS 477887-57-3), with molecular formula C20H17ClN2O5S3 and molecular weight 496.00 g/mol. IUPAC: methyl 3-[[2-[2-[(2-chlorophenyl)sulfonylamino]phenyl]sulfanylacetyl]amino]thiophene-2-carboxylate.
Chemical Property Profile of 2P-504S
Property Insights of 2P-504S
The XLogP value of 4.7197 indicates that 2P-504S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 2P-504S. Following Lipinski's Rule of Five, 2P-504S 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 2P-504S?
The CAS number of 2P-504S is 477887-57-3.
What is the molecular formula of 2P-504S?
The molecular formula of 2P-504S is C20H17ClN2O5S3.
What is the molecular weight of 2P-504S?
The molecular weight of 2P-504S is 496.00 g/mol.
Where can I buy 2P-504S?
You can request a quote for 2P-504S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2P-504S?
Yes, KEHONG BIO provides custom synthesis services for 2P-504S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.