N-benzyl-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-N-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-benzyl-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-N-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxamide
N-benzyl-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-N-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G859-0046 |
| Compound Name: | N-benzyl-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-N-methyl-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 537.66 |
| Molecular Formula: | C32 H28 F N3 O2 S |
| Smiles: | Cc1ccc(C)c(CSC2=Nc3cc(ccc3C(N2c2cccc(c2)F)=O)C(N(C)Cc2ccccc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.4365 |
| logD: | 6.436 |
| logSw: | -5.6479 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.31 |
| InChI Key: | YBFVGFTXVHQGEU-UHFFFAOYSA-N |