AF-399/15539286
TL;DR: AF-399/15539286 (CAS 315683-36-4) is a chemical compound with molecular formula C21H25N3O2S and molecular weight 383.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dimethoxyphenyl)ethyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2,4,6-tetraen-3-amine
Also Known As: AF-399/15539286, N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)amine, N-[2-(3,4-Dimethoxyphenyl)ethyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2,4,6-tetraen-3-amine, N-(3,4-dimethoxyphenethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-amine, N-(3,4-DIMETHOXYPHENETHYL)-N-(6,7,8,9-TETRAHYDRO-5H-CYCLOHEPTA[4,5]THIENO[2,3-D]PYRIMIDIN-4-YL)AMINE
| Molecular Formula | C21H25N3O2S |
|---|---|
| Molecular Weight | 383.17 g/mol |
| LogP | 4.632 |
| Topological Polar Surface Area | 56.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 383.16675 |
| Heavy Atoms | 27 |
| Complexity | 938.5666 |
Chemical Identifiers
| CAS Number | 315683-36-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC2=C3C4=C(CCCCC4)SC3=NC=N2)OC |
Product Overview
AF-399/15539286 (CAS 315683-36-4), with molecular formula C21H25N3O2S and molecular weight 383.17 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2,4,6-tetraen-3-amine.
Chemical Property Profile of AF-399/15539286
Property Insights of AF-399/15539286
The XLogP value of 4.632 indicates that AF-399/15539286 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.27 Ų, AF-399/15539286 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/15539286 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-399/15539286?
The CAS number of AF-399/15539286 is 315683-36-4.
What is the molecular formula of AF-399/15539286?
The molecular formula of AF-399/15539286 is C21H25N3O2S.
What is the molecular weight of AF-399/15539286?
The molecular weight of AF-399/15539286 is 383.17 g/mol.
Where can I buy AF-399/15539286?
You can request a quote for AF-399/15539286 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15539286?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15539286 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.