2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(3-methoxyphenyl)-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(3-methoxyphenyl)-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(3-methoxyphenyl)-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-1111 |
| Compound Name: | 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-(3-methoxyphenyl)-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 505.57 |
| Molecular Formula: | C27 H24 F N3 O4 S |
| Smiles: | CCCNC(c1ccc2C(N(C(=Nc2c1)SCC(c1ccc(cc1)F)=O)c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9381 |
| logD: | 3.938 |
| logSw: | -4.1123 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.477 |
| InChI Key: | DHBQHHHIOXRQCB-UHFFFAOYSA-N |