2P-511S
TL;DR: 2P-511S (CAS 477887-63-1) is a chemical compound with molecular formula C22H20N2O4S2 and molecular weight 440.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[2-[2-[(3-methylbenzoyl)amino]phenyl]sulfanylacetyl]amino]thiophene-2-carboxylate
Also Known As: 2P-511S, Methyl 3-[[2-[2-[(3-methylbenzoyl)amino]phenyl]sulfanylacetyl]amino]thiophene-2-carboxylate, methyl 3-{[2-({2-[(3-methylbenzoyl)amino]phenyl}sulfanyl)acetyl]amino}-2-thiophenecarboxylate, methyl 3-(2-{[2-(3-methylbenzamido)phenyl]sulfanyl}acetamido)thiophene-2-carboxylate, methyl3-(2-{[2-(3-methylbenzamido)phenyl]sulfanyl}acetamido)thiophene-2-carboxylate
| Molecular Formula | C22H20N2O4S2 |
|---|---|
| Molecular Weight | 440.09 g/mol |
| LogP | 4.82622 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 440.08646 |
| Heavy Atoms | 30 |
| Complexity | 1078.2593 |
Chemical Identifiers
| CAS Number | 477887-63-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC2=CC=CC=C2SCC(=O)NC3=C(SC=C3)C(=O)OC |
Product Overview
2P-511S (CAS 477887-63-1), with molecular formula C22H20N2O4S2 and molecular weight 440.09 g/mol. IUPAC: methyl 3-[[2-[2-[(3-methylbenzoyl)amino]phenyl]sulfanylacetyl]amino]thiophene-2-carboxylate.
Chemical Property Profile of 2P-511S
Property Insights of 2P-511S
The XLogP value of 4.82622 indicates that 2P-511S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2P-511S. Following Lipinski's Rule of Five, 2P-511S has 2 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 2P-511S?
The CAS number of 2P-511S is 477887-63-1.
What is the molecular formula of 2P-511S?
The molecular formula of 2P-511S is C22H20N2O4S2.
What is the molecular weight of 2P-511S?
The molecular weight of 2P-511S is 440.09 g/mol.
Where can I buy 2P-511S?
You can request a quote for 2P-511S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2P-511S?
Yes, KEHONG BIO provides custom synthesis services for 2P-511S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.