A3307/0140569
TL;DR: A3307/0140569 (CAS 577998-81-3) is a chemical compound with molecular formula C28H23ClN4OS and molecular weight 498.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-[[5-cyclopropyl-4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one
Also Known As: A3307/0140569, 6-chloro-3-{[5-cyclopropyl-4-(2,4-dimethylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-phenylquinolin-2(1H)-one, 6-chloro-3-((5-cyclopropyl-4-(2,4-dimethylphenyl)-4H-1,2,4-triazol-3-yl)thio)-4-phenylquinolin-2(1H)-one, 6-chloro-3-[[5-cyclopropyl-4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one, 6-CHLORO-3-{[5-CYCLOPROPYL-4-(2,4-DIMETHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}-4-PHENYL-1,2-DIHYDROQUINOLIN-2-ONE
| Molecular Formula | C28H23ClN4OS |
|---|---|
| Molecular Weight | 498.13 g/mol |
| LogP | 7.07464 |
| Topological Polar Surface Area | 63.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 498.1281 |
| Heavy Atoms | 35 |
| Complexity | 1636.9178 |
Chemical Identifiers
| CAS Number | 577998-81-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C(=NN=C2SC3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5)C6CC6)C |
Product Overview
A3307/0140569 (CAS 577998-81-3), with molecular formula C28H23ClN4OS and molecular weight 498.13 g/mol. IUPAC: 6-chloro-3-[[5-cyclopropyl-4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-4-phenyl-1H-quinolin-2-one.
Chemical Property Profile of A3307/0140569
Property Insights of A3307/0140569
The XLogP value of 7.07464 indicates that A3307/0140569 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.57 Ų falls within the moderate polarity range, balancing permeability and solubility for A3307/0140569. Following Lipinski's Rule of Five, A3307/0140569 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3307/0140569?
The CAS number of A3307/0140569 is 577998-81-3.
What is the molecular formula of A3307/0140569?
The molecular formula of A3307/0140569 is C28H23ClN4OS.
What is the molecular weight of A3307/0140569?
The molecular weight of A3307/0140569 is 498.13 g/mol.
Where can I buy A3307/0140569?
You can request a quote for A3307/0140569 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3307/0140569?
Yes, KEHONG BIO provides custom synthesis services for A3307/0140569 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.