2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-N,N-diethyl-3-(3-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-N,N-diethyl-3-(3-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-N,N-diethyl-3-(3-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G859-0093 |
| Compound Name: | 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-N,N-diethyl-3-(3-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 489.61 |
| Molecular Formula: | C28 H28 F N3 O2 S |
| Smiles: | CCN(CC)C(c1ccc2C(N(C(=Nc2c1)SCc1cc(C)ccc1C)c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.279 |
| logD: | 5.2785 |
| logSw: | -5.2206 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.092 |
| InChI Key: | FOPPNJINUCRIPL-UHFFFAOYSA-N |