ChemDiv1_008095
TL;DR: ChemDiv1_008095 (CAS 441737-71-9) is a chemical compound with molecular formula C28H32N4O3 and molecular weight 472.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[2-[4-(6-methyl-4-phenylquinazolin-2-yl)piperazin-1-yl]-2-oxoethyl]cyclopentyl]acetic acid
Also Known As: ChemDiv1_008095, 2-(1-{2-[4-(6-methyl-4-phenyl-2-quinazolinyl)piperazino]-2-oxoethyl}cyclopentyl)acetic acid, 2-(1-(2-(4-(6-methyl-4-phenylquinazolin-2-yl)piperazin-1-yl)-2-oxoethyl)cyclopentyl)acetic acid, 2-[1-[2-[4-(6-methyl-4-phenylquinazolin-2-yl)piperazin-1-yl]-2-oxoethyl]cyclopentyl]acetic acid
| Molecular Formula | C28H32N4O3 |
|---|---|
| Molecular Weight | 472.25 g/mol |
| LogP | 4.67902 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 472.24744 |
| Heavy Atoms | 35 |
| Complexity | 1229.6859 |
Chemical Identifiers
| CAS Number | 441737-71-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)N4CCN(CC4)C(=O)CC5(CCCC5)CC(=O)O |
Product Overview
ChemDiv1_008095 (CAS 441737-71-9), with molecular formula C28H32N4O3 and molecular weight 472.25 g/mol. IUPAC: 2-[1-[2-[4-(6-methyl-4-phenylquinazolin-2-yl)piperazin-1-yl]-2-oxoethyl]cyclopentyl]acetic acid.
Chemical Property Profile of ChemDiv1_008095
Property Insights of ChemDiv1_008095
The XLogP value of 4.67902 indicates that ChemDiv1_008095 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_008095. Following Lipinski's Rule of Five, ChemDiv1_008095 has 1 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 ChemDiv1_008095?
The CAS number of ChemDiv1_008095 is 441737-71-9.
What is the molecular formula of ChemDiv1_008095?
The molecular formula of ChemDiv1_008095 is C28H32N4O3.
What is the molecular weight of ChemDiv1_008095?
The molecular weight of ChemDiv1_008095 is 472.25 g/mol.
Where can I buy ChemDiv1_008095?
You can request a quote for ChemDiv1_008095 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008095?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008095 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.