ChemDiv3_012725
TL;DR: ChemDiv3_012725 (CAS 689770-74-9) is a chemical compound with molecular formula C19H15N3O2S2 and molecular weight 381.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxo-N-(2-phenylethyl)-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Also Known As: ChemDiv3_012725, BRD-K93877400-001-01-8, 5-Oxo-N-phenethyl-1-thioxo-4,5-dihydro-1H-thiazolo[3,4-a]quinazoline-3-carboxamide, 5-OXO-N-(2-PHENYLETHYL)-1-SULFANYLIDENE-1H,4H,5H-[1,3]THIAZOLO[3,4-A]QUINAZOLINE-3-CARBOXAMIDE, 5-oxo-N-phenethyl-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
| Molecular Formula | C19H15N3O2S2 |
|---|---|
| Molecular Weight | 381.06 g/mol |
| LogP | 3.54429 |
| Topological Polar Surface Area | 66.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.06058 |
| Heavy Atoms | 26 |
| Complexity | 1222.4792 |
Chemical Identifiers
| CAS Number | 689770-74-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC(=O)C2=C3NC(=O)C4=CC=CC=C4N3C(=S)S2 |
Product Overview
ChemDiv3_012725 (CAS 689770-74-9), with molecular formula C19H15N3O2S2 and molecular weight 381.06 g/mol. IUPAC: 5-oxo-N-(2-phenylethyl)-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide.
Chemical Property Profile of ChemDiv3_012725
Property Insights of ChemDiv3_012725
The XLogP value of 3.54429 indicates that ChemDiv3_012725 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.37 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_012725. Following Lipinski's Rule of Five, ChemDiv3_012725 has 2 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_012725?
The CAS number of ChemDiv3_012725 is 689770-74-9.
What is the molecular formula of ChemDiv3_012725?
The molecular formula of ChemDiv3_012725 is C19H15N3O2S2.
What is the molecular weight of ChemDiv3_012725?
The molecular weight of ChemDiv3_012725 is 381.06 g/mol.
Where can I buy ChemDiv3_012725?
You can request a quote for ChemDiv3_012725 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_012725?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_012725 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.