N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-0696 |
| Compound Name: | N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C22 H23 N3 O3 S |
| Smiles: | C1CN(CCN1C(c1ccccc1NC(C1=CSCCO1)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6973 |
| logD: | 2.1661 |
| logSw: | -3.5773 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.169 |
| InChI Key: | BLYSUUTVEBUOTF-UHFFFAOYSA-N |