AF-399/40878819
TL;DR: AF-399/40878819 (CAS 379238-98-9) is a chemical compound with molecular formula C24H21ClN4O2S and molecular weight 464.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorobenzoyl)-3-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]azepan-2-one
Also Known As: AF-399/40878819, 1-(4-CHLOROBENZOYL)-3-({5-METHYL-[1,2,4]TRIAZOLO[4,3-A]QUINOLIN-1-YL}SULFANYL)AZEPAN-2-ONE, 2H-Azepin-2-one, 1-(4-chlorobenzoyl)hexahydro-3-[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio]-, 1-(4-CL-BENZOYL)-3-((5-ME(1,2,4)TRIAZOLO(4,3-A)QUINOLIN-1-YL)THIO)-2-AZEPANONE, 1-(4-chlorobenzoyl)-3-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]azepan-2-one
| Molecular Formula | C24H21ClN4O2S |
|---|---|
| Molecular Weight | 464.11 g/mol |
| LogP | 5.15792 |
| Topological Polar Surface Area | 67.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 464.10736 |
| Heavy Atoms | 32 |
| Complexity | 1335.3479 |
Chemical Identifiers
| CAS Number | 379238-98-9 |
|---|---|
| SMILES | CC1=CC2=NN=C(N2C3=CC=CC=C13)SC4CCCCN(C4=O)C(=O)C5=CC=C(C=C5)Cl |
Product Overview
AF-399/40878819 (CAS 379238-98-9), with molecular formula C24H21ClN4O2S and molecular weight 464.11 g/mol. IUPAC: 1-(4-chlorobenzoyl)-3-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]azepan-2-one.
Chemical Property Profile of AF-399/40878819
Property Insights of AF-399/40878819
The XLogP value of 5.15792 indicates that AF-399/40878819 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.57 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40878819. Following Lipinski's Rule of Five, AF-399/40878819 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AF-399/40878819?
The CAS number of AF-399/40878819 is 379238-98-9.
What is the molecular formula of AF-399/40878819?
The molecular formula of AF-399/40878819 is C24H21ClN4O2S.
What is the molecular weight of AF-399/40878819?
The molecular weight of AF-399/40878819 is 464.11 g/mol.
Where can I buy AF-399/40878819?
You can request a quote for AF-399/40878819 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40878819?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40878819 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.