4(3H)-Quinazolinone, 3-pentyl-
TL;DR: 4(3H)-Quinazolinone, 3-pentyl- (CAS 16347-52-7) is a chemical compound with molecular formula C13H16N2O and molecular weight 216.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-pentylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 3-pentyl-, 3-pentylquinazolin-4-one, 3-Pentyl-4(3H)-quinazolinone, 4-Quinazolone, 3-pentyl, 3-Pentylquinazolin-4(3H)-one
| Molecular Formula | C13H16N2O |
|---|---|
| Molecular Weight | 216.13 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 216.12627 |
| Heavy Atoms | 16 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 16347-52-7 |
|---|---|
| SMILES | CCCCCN1C=NC2=CC=CC=C2C1=O |
| InChIKey | NWGZMFRPINJEAC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4(3H)-Quinazolinone, 3-pentyl- (CAS 16347-52-7), with molecular formula C13H16N2O and molecular weight 216.13 g/mol. IUPAC: 3-pentylquinazolin-4-one.
Chemical Property Profile of 4(3H)-Quinazolinone, 3-pentyl-
Property Insights of 4(3H)-Quinazolinone, 3-pentyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(3H)-Quinazolinone, 3-pentyl-. With a topological polar surface area (TPSA) of 32.7 Ų, 4(3H)-Quinazolinone, 3-pentyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 3-pentyl- has 0 hydrogen bond donor(s) and 2 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 4(3H)-Quinazolinone, 3-pentyl-?
The CAS number of 4(3H)-Quinazolinone, 3-pentyl- is 16347-52-7.
What is the molecular formula of 4(3H)-Quinazolinone, 3-pentyl-?
The molecular formula of 4(3H)-Quinazolinone, 3-pentyl- is C13H16N2O.
What is the molecular weight of 4(3H)-Quinazolinone, 3-pentyl-?
The molecular weight of 4(3H)-Quinazolinone, 3-pentyl- is 216.13 g/mol.
Where can I buy 4(3H)-Quinazolinone, 3-pentyl-?
You can request a quote for 4(3H)-Quinazolinone, 3-pentyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(3H)-Quinazolinone, 3-pentyl-?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinone, 3-pentyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.