AF-399/15599190
TL;DR: AF-399/15599190 (CAS 379244-07-2) is a chemical compound with molecular formula C23H26N4OS3 and molecular weight 470.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
Also Known As: AF-399/15599190, N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide, N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
| Molecular Formula | C23H26N4OS3 |
|---|---|
| Molecular Weight | 470.13 g/mol |
| LogP | 6.12312 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 470.12686 |
| Heavy Atoms | 31 |
| Complexity | 1196.3195 |
Chemical Identifiers
| CAS Number | 379244-07-2 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=NC=N2)SCC(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C#N)C |
Product Overview
AF-399/15599190 (CAS 379244-07-2), with molecular formula C23H26N4OS3 and molecular weight 470.13 g/mol. IUPAC: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide.
Chemical Property Profile of AF-399/15599190
Property Insights of AF-399/15599190
The XLogP value of 6.12312 indicates that AF-399/15599190 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/15599190. Following Lipinski's Rule of Five, AF-399/15599190 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/15599190?
The CAS number of AF-399/15599190 is 379244-07-2.
What is the molecular formula of AF-399/15599190?
The molecular formula of AF-399/15599190 is C23H26N4OS3.
What is the molecular weight of AF-399/15599190?
The molecular weight of AF-399/15599190 is 470.13 g/mol.
Where can I buy AF-399/15599190?
You can request a quote for AF-399/15599190 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15599190?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15599190 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.