Qc 1
TL;DR: Qc 1 (CAS 403718-45-6) is a chemical compound with molecular formula C23H16F3N3O2S and molecular weight 455.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-quinazoline-7-carboxamide
Also Known As: Qc 1, qc1, Qc1, >=98% (HPLC), N-benzyl-4-oxo-2-thioxo-3-(3-(trifluoromethyl)phenyl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide, 1,2,3,4-Tetrahydro-4-oxo-N-(phenylmethyl)-2-thioxo-3-[3-(trifluoromethyl)phenyl]-7-quinazolinecarboxamide
| Molecular Formula | C23H16F3N3O2S |
|---|---|
| Molecular Weight | 455.09 g/mol |
| LogP | 4.99709 |
| Topological Polar Surface Area | 66.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 455.09152 |
| Heavy Atoms | 32 |
| Complexity | 1426.614 |
Chemical Identifiers
| CAS Number | 403718-45-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
Qc 1 (CAS 403718-45-6), with molecular formula C23H16F3N3O2S and molecular weight 455.09 g/mol. IUPAC: N-benzyl-4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-quinazoline-7-carboxamide.
Chemical Property Profile of Qc 1
Property Insights of Qc 1
The XLogP value of 4.99709 indicates that Qc 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.89 Ų falls within the moderate polarity range, balancing permeability and solubility for Qc 1. Following Lipinski's Rule of Five, Qc 1 has 2 hydrogen bond donor(s) and 3 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 Qc 1?
The CAS number of Qc 1 is 403718-45-6.
What is the molecular formula of Qc 1?
The molecular formula of Qc 1 is C23H16F3N3O2S.
What is the molecular weight of Qc 1?
The molecular weight of Qc 1 is 455.09 g/mol.
Where can I buy Qc 1?
You can request a quote for Qc 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Qc 1?
Yes, KEHONG BIO provides custom synthesis services for Qc 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.