ChemDiv1_013719
TL;DR: ChemDiv1_013719 (CAS 422292-76-0) is a chemical compound with molecular formula C30H32N4O5S and molecular weight 560.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-4-[[2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]methyl]cyclohexane-1-carboxamide
Also Known As: ChemDiv1_013719, F3407-3972, N-[(furan-2-yl)methyl]-4-{[2-({[(3-methoxyphenyl)carbamoyl]methyl}sulfanyl)-4-oxo-3,4-dihydroquinazolin-3-yl]methyl}cyclohexane-1-carboxamide, N-(furan-2-ylmethyl)-4-[[2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]methyl]cyclohexane-1-carboxamide, N-(2-furylmethyl)-4-{[2-({2-[(3-methoxyphenyl)amino]-2-oxoethyl}thio)-4-oxoquinazolin-3(4H)-yl]methyl}cyclohexanecarboxamide
| Molecular Formula | C30H32N4O5S |
|---|---|
| Molecular Weight | 560.21 g/mol |
| LogP | 4.8517 |
| Topological Polar Surface Area | 115.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 560.20935 |
| Heavy Atoms | 40 |
| Complexity | 1526.8964 |
Chemical Identifiers
| CAS Number | 422292-76-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4CCC(CC4)C(=O)NCC5=CC=CO5 |
Product Overview
ChemDiv1_013719 (CAS 422292-76-0), with molecular formula C30H32N4O5S and molecular weight 560.21 g/mol. IUPAC: N-(furan-2-ylmethyl)-4-[[2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]methyl]cyclohexane-1-carboxamide.
Chemical Property Profile of ChemDiv1_013719
Property Insights of ChemDiv1_013719
The XLogP value of 4.8517 indicates that ChemDiv1_013719 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.46 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_013719. Following Lipinski's Rule of Five, ChemDiv1_013719 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_013719?
The CAS number of ChemDiv1_013719 is 422292-76-0.
What is the molecular formula of ChemDiv1_013719?
The molecular formula of ChemDiv1_013719 is C30H32N4O5S.
What is the molecular weight of ChemDiv1_013719?
The molecular weight of ChemDiv1_013719 is 560.21 g/mol.
Where can I buy ChemDiv1_013719?
You can request a quote for ChemDiv1_013719 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_013719?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_013719 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.