N-(3-cyano-4-fluorophenyl)-3-(3-methylphenyl)-4-oxo-2-(pyrrolidin-1-yl)-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-(3-cyano-4-fluorophenyl)-3-(3-methylphenyl)-4-oxo-2-(pyrrolidin-1-yl)-3,4-dihydroquinazoline-7-carboxamide
N-(3-cyano-4-fluorophenyl)-3-(3-methylphenyl)-4-oxo-2-(pyrrolidin-1-yl)-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F072-1110 |
| Compound Name: | N-(3-cyano-4-fluorophenyl)-3-(3-methylphenyl)-4-oxo-2-(pyrrolidin-1-yl)-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 467.5 |
| Molecular Formula: | C27 H22 F N5 O2 |
| Smiles: | Cc1cccc(c1)N1C(=Nc2cc(ccc2C1=O)C(Nc1ccc(c(C#N)c1)F)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.2608 |
| logD: | 3.9246 |
| logSw: | -4.2734 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.725 |
| InChI Key: | VFONKUBYIZZQPT-UHFFFAOYSA-N |