ChemDiv1_013323
TL;DR: ChemDiv1_013323 (CAS 422278-87-3) is a chemical compound with molecular formula C32H35N5O4S and molecular weight 585.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-6-morpholin-4-ylquinazolin-4-one
Also Known As: ChemDiv1_013323, F0916-4632, 3-benzyl-2-({2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-6-(morpholin-4-yl)-3,4-dihydroquinazolin-4-one, 3-benzyl-2-((2-(4-(2-methoxyphenyl)piperazin-1-yl)-2-oxoethyl)thio)-6-morpholinoquinazolin-4(3H)-one, 3-benzyl-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-6-morpholin-4-ylquinazolin-4-one
| Molecular Formula | C32H35N5O4S |
|---|---|
| Molecular Weight | 585.24 g/mol |
| LogP | 3.7309 |
| Topological Polar Surface Area | 80.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 585.24097 |
| Heavy Atoms | 42 |
| Complexity | 1598.084 |
Chemical Identifiers
| CAS Number | 422278-87-3 |
|---|---|
| SMILES | COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NC4=C(C=C(C=C4)N5CCOCC5)C(=O)N3CC6=CC=CC=C6 |
Product Overview
ChemDiv1_013323 (CAS 422278-87-3), with molecular formula C32H35N5O4S and molecular weight 585.24 g/mol. IUPAC: 3-benzyl-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-6-morpholin-4-ylquinazolin-4-one.
Chemical Property Profile of ChemDiv1_013323
Property Insights of ChemDiv1_013323
The XLogP value of 3.7309 indicates that ChemDiv1_013323 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.14 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_013323. Following Lipinski's Rule of Five, ChemDiv1_013323 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_013323?
The CAS number of ChemDiv1_013323 is 422278-87-3.
What is the molecular formula of ChemDiv1_013323?
The molecular formula of ChemDiv1_013323 is C32H35N5O4S.
What is the molecular weight of ChemDiv1_013323?
The molecular weight of ChemDiv1_013323 is 585.24 g/mol.
Where can I buy ChemDiv1_013323?
You can request a quote for ChemDiv1_013323 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_013323?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_013323 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.