2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydroquinazoline-7-carboxamide
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K284-4449 |
| Compound Name: | 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-3-[(furan-2-yl)methyl]-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 537.61 |
| Molecular Formula: | C28 H28 F N3 O5 S |
| Smiles: | CC(C)OCCCNC(c1ccc2C(N(Cc3ccco3)C(=Nc2c1)SCC(c1ccc(cc1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5595 |
| logD: | 3.5595 |
| logSw: | -3.9609 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.494 |
| InChI Key: | DDAXALMPBWSFLI-UHFFFAOYSA-N |