1-(7,7-Dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-3-phenylurea
Basic information
- CAS
126993-18-8- Standard SMILES
CC1(C)CC(=O)c2cnc(NC(=O)Nc3ccccc3)nc2C1- InChIKey
MNLLFLIDPCVMPT-UHFFFAOYSA-N- Molecular formula
- C17H18N4O2
- Average molar mass
- 310.35 g/mol
- Monoisotopic mass
- 310.14297583
Names & identifiers
- Preferred name
- 1-(7,7-Dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-3-phenylurea
- IUPAC
- 1-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-3-phenylurea
Names & synonyms
126993-18-8N-Phenyl-N'-(5,6,7,8-tetrahydro-7,7-dimethyl-5-oxo-2-quinazolinyl)ureaDTXSID3011532091-(7,7-dimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)-3-phenylureaSTK1499551-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-phenylureaAKOS001765647CCG-123502ST50764475N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-2-quinazolinyl)-N'-phenylureaN-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-N'-phenylureaN-(7,7-dimethyl-5-oxo(6,7,8-trihydroquinazolin-2-yl))(phenylamino)carboxamide
Show more names
N-Phenyl-Na(2)-(5,6,7,8-tetrahydro-7,7-dimethyl-5-oxo-2-quinazolinyl)urea
Database identifiers
- CAS
126993-18-8- PubChem CID
- 972826
- DTXSID
DTXSID301153209
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 460
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Compound notes
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