3-amino-2-(4-pentynyl)-4(3H)-quinazolinone
TL;DR: 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone (CAS 98750-87-9) is a chemical compound with molecular formula C13H13N3O and molecular weight 227.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-2-pent-4-ynylquinazolin-4-one
Also Known As: 3-amino-2-pent-4-ynylquinazolin-4-one, 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone, AD-310/37069069
| Molecular Formula | C13H13N3O |
|---|---|
| Molecular Weight | 227.11 g/mol |
| LogP | 1.0662 |
| Topological Polar Surface Area | 60.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.10587 |
| Heavy Atoms | 17 |
| Complexity | 637.13513 |
Chemical Identifiers
| CAS Number | 98750-87-9 |
|---|---|
| SMILES | C#CCCCC1=NC2=CC=CC=C2C(=O)N1N |
Product Overview
3-amino-2-(4-pentynyl)-4(3H)-quinazolinone (CAS 98750-87-9), with molecular formula C13H13N3O and molecular weight 227.11 g/mol. IUPAC: 3-amino-2-pent-4-ynylquinazolin-4-one.
Chemical Property Profile of 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone
Property Insights of 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone
The XLogP value of 1.0662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone. The TPSA of 60.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone. Following Lipinski's Rule of Five, 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone has 1 hydrogen bond donor(s) and 3 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 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone?
The CAS number of 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone is 98750-87-9.
What is the molecular formula of 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone?
The molecular formula of 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone is C13H13N3O.
What is the molecular weight of 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone?
The molecular weight of 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone is 227.11 g/mol.
Where can I buy 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone?
You can request a quote for 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone?
Yes, KEHONG BIO provides custom synthesis services for 3-amino-2-(4-pentynyl)-4(3H)-quinazolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.