2-{[2-(3-chlorophenyl)-2-oxoethyl]sulfanyl}-N-cyclopentyl-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[2-(3-chlorophenyl)-2-oxoethyl]sulfanyl}-N-cyclopentyl-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-{[2-(3-chlorophenyl)-2-oxoethyl]sulfanyl}-N-cyclopentyl-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-0557 |
| Compound Name: | 2-{[2-(3-chlorophenyl)-2-oxoethyl]sulfanyl}-N-cyclopentyl-3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 548.06 |
| Molecular Formula: | C29 H26 Cl N3 O4 S |
| Smiles: | COc1ccc(cc1)N1C(=Nc2cc(ccc2C1=O)C(NC1CCCC1)=O)SCC(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.277 |
| logD: | 5.2769 |
| logSw: | -5.8248 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.455 |
| InChI Key: | FNIPAGZTMHGEOS-UHFFFAOYSA-N |