1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea
TL;DR: 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea (CAS 517869-57-7) is a chemical compound with molecular formula C17H16Cl2N4O2 and molecular weight 378.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)urea
Also Known As: 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea, AJ-292/42151589, 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)urea, N-(3,4-dichlorophenyl)-N'-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-2-quinazolinyl)urea, [(3,4-dichlorophenyl)amino]-N-(7,7-dimethyl-5-oxo(6,7,8-trihydroquinazolin-2-y l))carboxamide
| Molecular Formula | C17H16Cl2N4O2 |
|---|---|
| Molecular Weight | 378.07 g/mol |
| LogP | 4.5825 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.06503 |
| Heavy Atoms | 25 |
| Complexity | 867.7215 |
Chemical Identifiers
| CAS Number | 517869-57-7 |
|---|---|
| SMILES | CC1(CC2=NC(=NC=C2C(=O)C1)NC(=O)NC3=CC(=C(C=C3)Cl)Cl)C |
Product Overview
1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea (CAS 517869-57-7), with molecular formula C17H16Cl2N4O2 and molecular weight 378.07 g/mol. IUPAC: 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)urea.
Chemical Property Profile of 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea
Property Insights of 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea
The XLogP value of 4.5825 indicates that 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea. Following Lipinski's Rule of Five, 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea has 2 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 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea?
The CAS number of 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea is 517869-57-7.
What is the molecular formula of 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea?
The molecular formula of 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea is C17H16Cl2N4O2.
What is the molecular weight of 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea?
The molecular weight of 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea is 378.07 g/mol.
Where can I buy 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea?
You can request a quote for 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-dichlorophenyl)-3-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.