ChemDiv3_012495
TL;DR: ChemDiv3_012495 (CAS 957358-99-5) is a chemical compound with molecular formula C19H16N4O2S and molecular weight 364.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-(3-oxo-5-sulfanylidene-1,2-dihydroimidazo[1,2-c]quinazolin-2-yl)acetamide
Also Known As: ChemDiv3_012495, BRD-A57658477-001-01-6, BRD-A57658477-001-02-4, N-benzyl-2-{3-oxo-5-sulfanylidene-2H,3H,5H,6H-imidazo[1,2-c]quinazolin-2-yl}acetamide, F6548-3633
| Molecular Formula | C19H16N4O2S |
|---|---|
| Molecular Weight | 364.10 g/mol |
| LogP | 2.90659 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 364.0994 |
| Heavy Atoms | 26 |
| Complexity | 1062.0723 |
Chemical Identifiers
| CAS Number | 957358-99-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)CC2C(=O)N3C(=C4C=CC=CC4=NC3=S)N2 |
Product Overview
ChemDiv3_012495 (CAS 957358-99-5), with molecular formula C19H16N4O2S and molecular weight 364.10 g/mol. IUPAC: N-benzyl-2-(3-oxo-5-sulfanylidene-1,2-dihydroimidazo[1,2-c]quinazolin-2-yl)acetamide.
Chemical Property Profile of ChemDiv3_012495
Property Insights of ChemDiv3_012495
The XLogP value of 2.90659 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_012495. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_012495. Following Lipinski's Rule of Five, ChemDiv3_012495 has 2 hydrogen bond donor(s) and 5 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_012495?
The CAS number of ChemDiv3_012495 is 957358-99-5.
What is the molecular formula of ChemDiv3_012495?
The molecular formula of ChemDiv3_012495 is C19H16N4O2S.
What is the molecular weight of ChemDiv3_012495?
The molecular weight of ChemDiv3_012495 is 364.10 g/mol.
Where can I buy ChemDiv3_012495?
You can request a quote for ChemDiv3_012495 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_012495?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_012495 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.