ChemDiv3_004272
TL;DR: ChemDiv3_004272 (CAS 380321-83-5) is a chemical compound with molecular formula C22H23N3O2S2 and molecular weight 425.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(2-phenyl-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl)ethyl]benzenesulfonamide
Also Known As: ChemDiv3_004272, IDI1_022182, BRD-K63099198-001-01-1, 4-[2-(2-phenyl-4-thioxo-5,6,7,8-tetrahydroquinazolin-1(4H)-yl)ethyl]benzenesulfonamide, 4-[2-(2-phenyl-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl)ethyl]benzenesulfonamide
| Molecular Formula | C22H23N3O2S2 |
|---|---|
| Molecular Weight | 425.12 g/mol |
| LogP | 4.04849 |
| Topological Polar Surface Area | 77.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.12317 |
| Heavy Atoms | 29 |
| Complexity | 1185.2222 |
Chemical Identifiers
| CAS Number | 380321-83-5 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=S)N=C(N2CCC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4 |
Product Overview
ChemDiv3_004272 (CAS 380321-83-5), with molecular formula C22H23N3O2S2 and molecular weight 425.12 g/mol. IUPAC: 4-[2-(2-phenyl-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl)ethyl]benzenesulfonamide.
Chemical Property Profile of ChemDiv3_004272
Property Insights of ChemDiv3_004272
The XLogP value of 4.04849 indicates that ChemDiv3_004272 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.98 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_004272. Following Lipinski's Rule of Five, ChemDiv3_004272 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv3_004272?
The CAS number of ChemDiv3_004272 is 380321-83-5.
What is the molecular formula of ChemDiv3_004272?
The molecular formula of ChemDiv3_004272 is C22H23N3O2S2.
What is the molecular weight of ChemDiv3_004272?
The molecular weight of ChemDiv3_004272 is 425.12 g/mol.
Where can I buy ChemDiv3_004272?
You can request a quote for ChemDiv3_004272 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_004272?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_004272 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.