2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one
TL;DR: 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one (CAS 126993-17-7) is a chemical compound with molecular formula C11H15N3O and molecular weight 205.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one
Also Known As: 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one, 2-amino-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one, BAS 01095365, 2-amino-4,7,7-trimethyl-5,6,7,8-tetrahydroquinazolin-5-one, 2-amino-4,7,7-trimethyl-6,7,8-trihydroquinazolin-5-one
| Molecular Formula | C11H15N3O |
|---|---|
| Molecular Weight | 205.12 g/mol |
| LogP | 1.52232 |
| Topological Polar Surface Area | 68.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 205.1215 |
| Heavy Atoms | 15 |
| Complexity | 437.7043 |
Chemical Identifiers
| CAS Number | 126993-17-7 |
|---|---|
| SMILES | CC1=C2C(=NC(=N1)N)CC(CC2=O)(C)C |
Product Overview
2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one (CAS 126993-17-7), with molecular formula C11H15N3O and molecular weight 205.12 g/mol. IUPAC: 2-amino-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one.
Chemical Property Profile of 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one
Property Insights of 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one
The XLogP value of 1.52232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one. The TPSA of 68.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one. Following Lipinski's Rule of Five, 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one has 1 hydrogen bond donor(s) and 4 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 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one?
The CAS number of 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one is 126993-17-7.
What is the molecular formula of 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one?
The molecular formula of 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one is C11H15N3O.
What is the molecular weight of 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one?
The molecular weight of 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one is 205.12 g/mol.
Where can I buy 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one?
You can request a quote for 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-4,7,7-trimethyl-7,8-dihydroquinazolin-5(6H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.