3-(4-fluorophenyl)-N-[(furan-2-yl)methyl]-4-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(4-fluorophenyl)-N-[(furan-2-yl)methyl]-4-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide
3-(4-fluorophenyl)-N-[(furan-2-yl)methyl]-4-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K289-0369 |
| Compound Name: | 3-(4-fluorophenyl)-N-[(furan-2-yl)methyl]-4-oxo-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 506.56 |
| Molecular Formula: | C26 H23 F N4 O4 S |
| Smiles: | C1CCN(C1)C(CSC1=Nc2cc(ccc2C(N1c1ccc(cc1)F)=O)C(NCc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2158 |
| logD: | 3.2154 |
| logSw: | -3.6695 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.08 |
| InChI Key: | XPEIYXBCKJRCHV-UHFFFAOYSA-N |