4-[(2,4-dioxo-1H-quinazolin-3-yl)methyl]-N-[3-(N-ethylanilino)propyl]benzamide
Basic information
- CAS
6782-13-4- Standard SMILES
CCN(CCCNC(=O)c1ccc(Cn2c(=O)[nH]c3ccccc3c2=O)cc1)c1ccccc1- InChIKey
FVNAAYGGMYMLNP-UHFFFAOYSA-N- Molecular formula
- C27H28N4O3
- Average molar mass
- 456.5 g/mol
- Monoisotopic mass
- 456.21614077
Names & identifiers
- Preferred name
- 4-[(2,4-dioxo-1H-quinazolin-3-yl)methyl]-N-[3-(N-ethylanilino)propyl]benzamide
- IUPAC
- 4-[(2,4-dioxo-1H-quinazolin-3-yl)methyl]-N-[3-(N-ethylanilino)propyl]benzamide
Names & synonyms
6782-13-4896374-27-94-[(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-{3-[ethyl(phenyl)amino]propyl}benzamide4-[(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)methyl]-N-{3-[ethyl(phenyl)amino]propyl}benzamideAC1NQ6AHDTXSID40410629AKOS0020892004-[(2,4-dioxo-1H-quinazolin-3-yl)methyl]-N-[3-(N-ethylanilino)propyl]benzamide4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)-N-(3-(ethyl(phenyl)amino)propyl)benzamideF3407-3732
Database identifiers
- CAS
6782-13-4- PubChem CID
- 5216014
- DTXSID
DTXSID40410629
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 700
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Compound notes
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