3-(4-fluorophenyl)-N-[3-(morpholin-4-yl)propyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(4-fluorophenyl)-N-[3-(morpholin-4-yl)propyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-(4-fluorophenyl)-N-[3-(morpholin-4-yl)propyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061797 |
| Compound Name: | 3-(4-fluorophenyl)-N-[3-(morpholin-4-yl)propyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C22 H23 F N4 O3 S |
| Smiles: | C(CNC(c1ccc2C(N(C(Nc2c1)=S)c1ccc(cc1)F)=O)=O)CN1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 1.7092 |
| logD: | 1.321 |
| logSw: | -2.6845 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.852 |
| InChI Key: | RSMAQPNVGHKSMV-UHFFFAOYSA-N |