AA-768/34978038
TL;DR: AA-768/34978038 (CAS 329079-79-0) is a chemical compound with molecular formula C29H20Cl2N2O3S and molecular weight 546.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one
Also Known As: AA-768/34978038, 2-((2-(4-((3,4-Dichlorobenzyl)oxy)phenyl)-2-oxoethyl)sulfanyl)-3-phenyl-4(3H)-quinazolinone, 2-[2-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one, 2-[(2-{4-[(3,4-dichlorophenyl)methoxy]phenyl}-2-oxoethyl)sulfanyl]-3-phenyl-3,4-dihydroquinazolin-4-one, 2-[(2-{4-[(3,4-dichlorobenzyl)oxy]phenyl}-2-oxoethyl)sulfanyl]-3-phenyl-4(3H)-quinazolinone
| Molecular Formula | C29H20Cl2N2O3S |
|---|---|
| Molecular Weight | 546.06 g/mol |
| LogP | 7.2465 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 546.0572 |
| Heavy Atoms | 37 |
| Complexity | 1637.7601 |
Chemical Identifiers
| CAS Number | 329079-79-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)OCC5=CC(=C(C=C5)Cl)Cl |
Product Overview
AA-768/34978038 (CAS 329079-79-0), with molecular formula C29H20Cl2N2O3S and molecular weight 546.06 g/mol. IUPAC: 2-[2-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one.
Chemical Property Profile of AA-768/34978038
Property Insights of AA-768/34978038
The XLogP value of 7.2465 indicates that AA-768/34978038 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AA-768/34978038. Following Lipinski's Rule of Five, AA-768/34978038 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 AA-768/34978038?
The CAS number of AA-768/34978038 is 329079-79-0.
What is the molecular formula of AA-768/34978038?
The molecular formula of AA-768/34978038 is C29H20Cl2N2O3S.
What is the molecular weight of AA-768/34978038?
The molecular weight of AA-768/34978038 is 546.06 g/mol.
Where can I buy AA-768/34978038?
You can request a quote for AA-768/34978038 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AA-768/34978038?
Yes, KEHONG BIO provides custom synthesis services for AA-768/34978038 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.