![2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one structure](/static/products/7142/714287-09-9.webp)
2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one
TL;DR: 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one (CAS 714287-09-9) is a chemical compound with molecular formula C16H17N3O and molecular weight 267.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,5-dimethylanilino)-7,8-dihydro-6H-quinazolin-5-one
Also Known As: 2-[(3,5-dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one, 2-(3,5-dimethylanilino)-7,8-dihydro-6H-quinazolin-5-one, 2-((3,5-dimethylphenyl)amino)-7,8-dihydroquinazolin-5(6H)-one, 2-[(3,5-dimethylphenyl)amino]-7,8-dihydroquinazolin-5(6H)-one, (2Z)-2-[(3,5-dimethylphenyl)imino]-2,6,7,8-tetrahydroquinazolin-5(1H)-one
| Molecular Formula | C16H17N3O |
|---|---|
| Molecular Weight | 267.14 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 54.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.13718 |
| Heavy Atoms | 20 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 714287-09-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC2=NC=C3C(=N2)CCCC3=O)C |
| InChIKey | USZPQRMQYJIDII-UHFFFAOYSA-N |
Product Overview
2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one (CAS 714287-09-9), with molecular formula C16H17N3O and molecular weight 267.14 g/mol. IUPAC: 2-(3,5-dimethylanilino)-7,8-dihydro-6H-quinazolin-5-one.
Chemical Property Profile of 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one
Property Insights of 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one. With a topological polar surface area (TPSA) of 54.9 Ų, 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-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-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one?
The CAS number of 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one is 714287-09-9.
What is the molecular formula of 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one?
The molecular formula of 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one is C16H17N3O.
What is the molecular weight of 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one?
The molecular weight of 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one is 267.14 g/mol.
Where can I buy 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one?
You can request a quote for 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3,5-Dimethylphenyl)amino]-6,7,8-trihydroquinazolin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.