N-(4-{[3-(4-phenylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-(4-{[3-(4-phenylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-(4-{[3-(4-phenylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0263 |
| Compound Name: | N-(4-{[3-(4-phenylpiperazin-1-yl)propyl]carbamoyl}phenyl)-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 466.6 |
| Molecular Formula: | C25 H30 N4 O3 S |
| Smiles: | C(CNC(c1ccc(cc1)NC(C1=CSCCO1)=O)=O)CN1CCN(CC1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.2905 |
| logD: | 1.7467 |
| logSw: | -2.8481 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.456 |
| InChI Key: | BEMJCWNLRMGNEB-UHFFFAOYSA-N |