AB00412570-09
TL;DR: AB00412570-09 (CAS 896371-86-1) is a chemical compound with molecular formula C22H30N4O5 and molecular weight 430.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxohexyl]-2,4-dioxo-1H-quinazoline-7-carboxylate
Also Known As: AB00412570-09, methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate, F6548-3289, methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxohexyl]-2,4-dioxo-1H-quinazoline-7-carboxylate, methyl 3-(6-(4-ethylpiperazin-1-yl)-6-oxohexyl)-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
| Molecular Formula | C22H30N4O5 |
|---|---|
| Molecular Weight | 430.22 g/mol |
| LogP | 1.2009 |
| Topological Polar Surface Area | 104.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.22162 |
| Heavy Atoms | 31 |
| Complexity | 1050.0278 |
Chemical Identifiers
| CAS Number | 896371-86-1 |
|---|---|
| SMILES | CCN1CCN(CC1)C(=O)CCCCCN2C(=O)C3=C(C=C(C=C3)C(=O)OC)NC2=O |
Product Overview
AB00412570-09 (CAS 896371-86-1), with molecular formula C22H30N4O5 and molecular weight 430.22 g/mol. IUPAC: methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxohexyl]-2,4-dioxo-1H-quinazoline-7-carboxylate.
Chemical Property Profile of AB00412570-09
Property Insights of AB00412570-09
The XLogP value of 1.2009 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00412570-09. The TPSA of 104.71 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00412570-09. Following Lipinski's Rule of Five, AB00412570-09 has 1 hydrogen bond donor(s) and 6 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 AB00412570-09?
The CAS number of AB00412570-09 is 896371-86-1.
What is the molecular formula of AB00412570-09?
The molecular formula of AB00412570-09 is C22H30N4O5.
What is the molecular weight of AB00412570-09?
The molecular weight of AB00412570-09 is 430.22 g/mol.
Where can I buy AB00412570-09?
You can request a quote for AB00412570-09 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00412570-09?
Yes, KEHONG BIO provides custom synthesis services for AB00412570-09 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.