AA-768/34978040
TL;DR: AA-768/34978040 (CAS 329079-80-3) is a chemical compound with molecular formula C23H17ClN2O2S and molecular weight 420.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3-chloro-4-methylphenyl)-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one
Also Known As: AA-768/34978040, 2-{[2-(3-chloro-4-methylphenyl)-2-oxoethyl]sulfanyl}-3-phenyl-4(3H)-quinazolinone, 2-[2-(3-chloro-4-methylphenyl)-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one, 2-((2-(3-Chloro-4-methylphenyl)-2-oxoethyl)sulfanyl)-3-phenyl-4(3H)-quinazolinone, 2-{[2-(3-chloro-4-methylphenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,4-dihydroquinazolin-4-one
| Molecular Formula | C23H17ClN2O2S |
|---|---|
| Molecular Weight | 420.07 g/mol |
| LogP | 5.32252 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.06992 |
| Heavy Atoms | 29 |
| Complexity | 1269.1077 |
Chemical Identifiers
| CAS Number | 329079-80-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)Cl |
Product Overview
AA-768/34978040 (CAS 329079-80-3), with molecular formula C23H17ClN2O2S and molecular weight 420.07 g/mol. IUPAC: 2-[2-(3-chloro-4-methylphenyl)-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one.
Chemical Property Profile of AA-768/34978040
Property Insights of AA-768/34978040
The XLogP value of 5.32252 indicates that AA-768/34978040 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, AA-768/34978040 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AA-768/34978040 has 0 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 AA-768/34978040?
The CAS number of AA-768/34978040 is 329079-80-3.
What is the molecular formula of AA-768/34978040?
The molecular formula of AA-768/34978040 is C23H17ClN2O2S.
What is the molecular weight of AA-768/34978040?
The molecular weight of AA-768/34978040 is 420.07 g/mol.
Where can I buy AA-768/34978040?
You can request a quote for AA-768/34978040 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AA-768/34978040?
Yes, KEHONG BIO provides custom synthesis services for AA-768/34978040 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.