AB00162672-02
TL;DR: AB00162672-02 (CAS 451467-45-1) is a chemical compound with molecular formula C25H29N3O6S and molecular weight 499.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[7-(furan-2-ylmethylcarbamoyl)-4-oxo-3-pentylquinazolin-2-yl]sulfanyl-3-oxobutanoate
Also Known As: AB00162672-02, F0916-6453, ethyl 4-((7-((furan-2-ylmethyl)carbamoyl)-4-oxo-3-pentyl-3,4-dihydroquinazolin-2-yl)thio)-3-oxobutanoate, ethyl 4-[(7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3-pentyl-3,4-dihydroquinazolin-2-yl)sulfanyl]-3-oxobutanoate, ethyl 4-[7-(furan-2-ylmethylcarbamoyl)-4-oxo-3-pentylquinazolin-2-yl]sulfanyl-3-oxobutanoate
| Molecular Formula | C25H29N3O6S |
|---|---|
| Molecular Weight | 499.18 g/mol |
| LogP | 3.7241 |
| Topological Polar Surface Area | 120.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 499.1777 |
| Heavy Atoms | 35 |
| Complexity | 1235.9731 |
Chemical Identifiers
| CAS Number | 451467-45-1 |
|---|---|
| SMILES | CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CO3)N=C1SCC(=O)CC(=O)OCC |
Product Overview
AB00162672-02 (CAS 451467-45-1), with molecular formula C25H29N3O6S and molecular weight 499.18 g/mol. IUPAC: ethyl 4-[7-(furan-2-ylmethylcarbamoyl)-4-oxo-3-pentylquinazolin-2-yl]sulfanyl-3-oxobutanoate.
Chemical Property Profile of AB00162672-02
Property Insights of AB00162672-02
The XLogP value of 3.7241 indicates that AB00162672-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.5 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00162672-02. Following Lipinski's Rule of Five, AB00162672-02 has 1 hydrogen bond donor(s) and 8 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 AB00162672-02?
The CAS number of AB00162672-02 is 451467-45-1.
What is the molecular formula of AB00162672-02?
The molecular formula of AB00162672-02 is C25H29N3O6S.
What is the molecular weight of AB00162672-02?
The molecular weight of AB00162672-02 is 499.18 g/mol.
Where can I buy AB00162672-02?
You can request a quote for AB00162672-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00162672-02?
Yes, KEHONG BIO provides custom synthesis services for AB00162672-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.