N-cyclopentyl-2-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-2-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
N-cyclopentyl-2-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-0556 |
| Compound Name: | N-cyclopentyl-2-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 541.67 |
| Molecular Formula: | C31 H31 N3 O4 S |
| Smiles: | Cc1ccc(C)c(c1)C(CSC1=Nc2cc(ccc2C(N1c1ccc(cc1)OC)=O)C(NC1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3712 |
| logD: | 5.3711 |
| logSw: | -5.3455 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.455 |
| InChI Key: | ICZYARJNEOXQHY-UHFFFAOYSA-N |