N-{4-[({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-{4-[({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-{4-[({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0339 |
| Compound Name: | N-{4-[({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)carbamoyl]phenyl}-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 483.6 |
| Molecular Formula: | C26 H30 F N3 O3 S |
| Smiles: | C1CN(CCC1CNC(c1ccc(cc1)NC(C1=CSCCO1)=O)=O)CCc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.2728 |
| logD: | 0.7919 |
| logSw: | -3.5749 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.083 |
| InChI Key: | DHMMXRLCRNQERX-UHFFFAOYSA-N |