AF-399/37418008
TL;DR: AF-399/37418008 (CAS 314261-68-2) is a chemical compound with molecular formula C17H23N3O2S and molecular weight 333.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,6-dimethylmorpholin-4-yl)acetamide
Also Known As: AF-399/37418008, VU0494050-1, F0863-0630, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,6-dimethylmorpholin-4-yl)acetamide, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(2,6-dimethyl-4-morpholinyl)acetamide
| Molecular Formula | C17H23N3O2S |
|---|---|
| Molecular Weight | 333.15 g/mol |
| LogP | 2.54628 |
| Topological Polar Surface Area | 65.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.1511 |
| Heavy Atoms | 23 |
| Complexity | 624.5184 |
Chemical Identifiers
| CAS Number | 314261-68-2 |
|---|---|
| SMILES | CC1CN(CC(O1)C)CC(=O)NC2=C(C3=C(S2)CCCC3)C#N |
Product Overview
AF-399/37418008 (CAS 314261-68-2), with molecular formula C17H23N3O2S and molecular weight 333.15 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,6-dimethylmorpholin-4-yl)acetamide.
Chemical Property Profile of AF-399/37418008
Property Insights of AF-399/37418008
The XLogP value of 2.54628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/37418008. The TPSA of 65.36 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/37418008. Following Lipinski's Rule of Five, AF-399/37418008 has 1 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-399/37418008?
The CAS number of AF-399/37418008 is 314261-68-2.
What is the molecular formula of AF-399/37418008?
The molecular formula of AF-399/37418008 is C17H23N3O2S.
What is the molecular weight of AF-399/37418008?
The molecular weight of AF-399/37418008 is 333.15 g/mol.
Where can I buy AF-399/37418008?
You can request a quote for AF-399/37418008 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/37418008?
Yes, KEHONG BIO provides custom synthesis services for AF-399/37418008 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.