AF-399/15336012
TL;DR: AF-399/15336012 (CAS 315685-17-7) is a chemical compound with molecular formula C17H24N2O4S and molecular weight 352.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(3-morpholin-4-ylpropanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AF-399/15336012, F1143-3788, METHYL 2-[3-(MORPHOLIN-4-YL)PROPANAMIDO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, methyl 2-(3-morpholinopropanamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, methyl 2-(3-morpholin-4-ylpropanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C17H24N2O4S |
|---|---|
| Molecular Weight | 352.15 g/mol |
| LogP | 2.0743 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.1457 |
| Heavy Atoms | 24 |
| Complexity | 607.97687 |
Chemical Identifiers
| CAS Number | 315685-17-7 |
|---|---|
| SMILES | COC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCN3CCOCC3 |
Product Overview
AF-399/15336012 (CAS 315685-17-7), with molecular formula C17H24N2O4S and molecular weight 352.15 g/mol. IUPAC: methyl 2-(3-morpholin-4-ylpropanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of AF-399/15336012
Property Insights of AF-399/15336012
The XLogP value of 2.0743 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/15336012. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15336012. Following Lipinski's Rule of Five, AF-399/15336012 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 AF-399/15336012?
The CAS number of AF-399/15336012 is 315685-17-7.
What is the molecular formula of AF-399/15336012?
The molecular formula of AF-399/15336012 is C17H24N2O4S.
What is the molecular weight of AF-399/15336012?
The molecular weight of AF-399/15336012 is 352.15 g/mol.
Where can I buy AF-399/15336012?
You can request a quote for AF-399/15336012 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15336012?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15336012 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.