ChemDiv1_013158
TL;DR: ChemDiv1_013158 (CAS 443348-20-7) is a chemical compound with molecular formula C26H24ClN3O4S and molecular weight 509.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-4-oxo-3-(oxolan-2-ylmethyl)quinazoline-7-carboxamide
Also Known As: ChemDiv1_013158, F0913-3390, 2-((4-chlorobenzyl)thio)-N-(furan-2-ylmethyl)-4-oxo-3-((tetrahydrofuran-2-yl)methyl)-3,4-dihydroquinazoline-7-carboxamide, 2-{[(4-chlorophenyl)methyl]sulfanyl}-N-[(furan-2-yl)methyl]-4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxamide, 2-[(4-chlorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-4-oxo-3-(oxolan-2-ylmethyl)quinazoline-7-carboxamide
| Molecular Formula | C26H24ClN3O4S |
|---|---|
| Molecular Weight | 509.12 g/mol |
| LogP | 5.0442 |
| Topological Polar Surface Area | 86.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 509.1176 |
| Heavy Atoms | 35 |
| Complexity | 1380.4967 |
Chemical Identifiers
| CAS Number | 443348-20-7 |
|---|---|
| SMILES | C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CO4)N=C2SCC5=CC=C(C=C5)Cl |
Product Overview
ChemDiv1_013158 (CAS 443348-20-7), with molecular formula C26H24ClN3O4S and molecular weight 509.12 g/mol. IUPAC: 2-[(4-chlorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-4-oxo-3-(oxolan-2-ylmethyl)quinazoline-7-carboxamide.
Chemical Property Profile of ChemDiv1_013158
Property Insights of ChemDiv1_013158
The XLogP value of 5.0442 indicates that ChemDiv1_013158 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.36 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_013158. Following Lipinski's Rule of Five, ChemDiv1_013158 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_013158?
The CAS number of ChemDiv1_013158 is 443348-20-7.
What is the molecular formula of ChemDiv1_013158?
The molecular formula of ChemDiv1_013158 is C26H24ClN3O4S.
What is the molecular weight of ChemDiv1_013158?
The molecular weight of ChemDiv1_013158 is 509.12 g/mol.
Where can I buy ChemDiv1_013158?
You can request a quote for ChemDiv1_013158 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_013158?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_013158 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.