N-cyclopentyl-2-{[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl}-3-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-2-{[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl}-3-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
N-cyclopentyl-2-{[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl}-3-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-1444 |
| Compound Name: | N-cyclopentyl-2-{[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl}-3-(4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 545.63 |
| Molecular Formula: | C30 H28 F N3 O4 S |
| Smiles: | CCOc1ccc(cc1)C(CSC1=Nc2cc(ccc2C(N1c1ccc(cc1)F)=O)C(NC1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7948 |
| logD: | 4.7947 |
| logSw: | -4.5987 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.035 |
| InChI Key: | XTKBFEHJKDJJMJ-UHFFFAOYSA-N |