N-[2-({3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-[2-({3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-[2-({3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0941 |
| Compound Name: | N-[2-({3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}carbamoyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 484.59 |
| Molecular Formula: | C25 H29 F N4 O3 S |
| Smiles: | C(CNC(c1ccccc1NC(C1=CSCCO1)=O)=O)CN1CCN(CC1)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.6672 |
| logD: | 2.1234 |
| logSw: | -3.4685 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.758 |
| InChI Key: | SZISRUHNJAGXOS-UHFFFAOYSA-N |