ChemDiv1_013675
TL;DR: ChemDiv1_013675 (CAS 422292-73-7) is a chemical compound with molecular formula C31H34N4O4S and molecular weight 558.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-4-[[4-oxo-2-[2-oxo-2-(2-phenylethylamino)ethyl]sulfanylquinazolin-3-yl]methyl]cyclohexane-1-carboxamide
Also Known As: ChemDiv1_013675, F3407-3970, N-[(furan-2-yl)methyl]-4-{[4-oxo-2-({[(2-phenylethyl)carbamoyl]methyl}sulfanyl)-3,4-dihydroquinazolin-3-yl]methyl}cyclohexane-1-carboxamide, N-(2-furylmethyl)-4-{[4-oxo-2-({2-oxo-2-[(2-phenylethyl)amino]ethyl}thio)quinazolin-3(4H)-yl]methyl}cyclohexanecarboxamide, N-(furan-2-ylmethyl)-4-((4-oxo-2-((2-oxo-2-(phenethylamino)ethyl)thio)quinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide
| Molecular Formula | C31H34N4O4S |
|---|---|
| Molecular Weight | 558.23 g/mol |
| LogP | 4.5633 |
| Topological Polar Surface Area | 106.23 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 558.2301 |
| Heavy Atoms | 40 |
| Complexity | 1478.51 |
Chemical Identifiers
| CAS Number | 422292-73-7 |
|---|---|
| SMILES | C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=CC=C4)C(=O)NCC5=CC=CO5 |
Product Overview
ChemDiv1_013675 (CAS 422292-73-7), with molecular formula C31H34N4O4S and molecular weight 558.23 g/mol. IUPAC: N-(furan-2-ylmethyl)-4-[[4-oxo-2-[2-oxo-2-(2-phenylethylamino)ethyl]sulfanylquinazolin-3-yl]methyl]cyclohexane-1-carboxamide.
Chemical Property Profile of ChemDiv1_013675
Property Insights of ChemDiv1_013675
The XLogP value of 4.5633 indicates that ChemDiv1_013675 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.23 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_013675. Following Lipinski's Rule of Five, ChemDiv1_013675 has 2 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_013675?
The CAS number of ChemDiv1_013675 is 422292-73-7.
What is the molecular formula of ChemDiv1_013675?
The molecular formula of ChemDiv1_013675 is C31H34N4O4S.
What is the molecular weight of ChemDiv1_013675?
The molecular weight of ChemDiv1_013675 is 558.23 g/mol.
Where can I buy ChemDiv1_013675?
You can request a quote for ChemDiv1_013675 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_013675?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_013675 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.