AF-399/15392031
TL;DR: AF-399/15392031 (CAS 308300-15-4) is a chemical compound with molecular formula C17H18N2O3S2 and molecular weight 362.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4,5-dimethyl-2-[(2-phenylacetyl)carbamothioylamino]thiophene-3-carboxylate
Also Known As: AF-399/15392031, methyl 4,5-dimethyl-2-({[(phenylacetyl)amino]carbothioyl}amino)-3-thiophenecarboxylate, methyl 4,5-dimethyl-2-[(2-phenylacetyl)carbamothioylamino]thiophene-3-carboxylate
| Molecular Formula | C17H18N2O3S2 |
|---|---|
| Molecular Weight | 362.08 g/mol |
| LogP | 3.20724 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.0759 |
| Heavy Atoms | 24 |
| Complexity | 769.6429 |
Chemical Identifiers
| CAS Number | 308300-15-4 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=S)NC(=O)CC2=CC=CC=C2)C |
Product Overview
AF-399/15392031 (CAS 308300-15-4), with molecular formula C17H18N2O3S2 and molecular weight 362.08 g/mol. IUPAC: methyl 4,5-dimethyl-2-[(2-phenylacetyl)carbamothioylamino]thiophene-3-carboxylate.
Chemical Property Profile of AF-399/15392031
Property Insights of AF-399/15392031
The XLogP value of 3.20724 indicates that AF-399/15392031 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15392031. Following Lipinski's Rule of Five, AF-399/15392031 has 2 hydrogen bond donor(s) and 5 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 AF-399/15392031?
The CAS number of AF-399/15392031 is 308300-15-4.
What is the molecular formula of AF-399/15392031?
The molecular formula of AF-399/15392031 is C17H18N2O3S2.
What is the molecular weight of AF-399/15392031?
The molecular weight of AF-399/15392031 is 362.08 g/mol.
Where can I buy AF-399/15392031?
You can request a quote for AF-399/15392031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15392031?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15392031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.