N-[2-methyl-5-(4-phenylpiperazine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Chemical Structure Depiction of
N-[2-methyl-5-(4-phenylpiperazine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
N-[2-methyl-5-(4-phenylpiperazine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Compound characteristics
| Compound ID: | G370-1355 |
| Compound Name: | N-[2-methyl-5-(4-phenylpiperazine-1-carbonyl)phenyl]-5,6-dihydro-1,4-oxathiine-2-carboxamide |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C23 H25 N3 O3 S |
| Smiles: | Cc1ccc(cc1NC(C1=CSCCO1)=O)C(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6112 |
| logD: | 2.6102 |
| logSw: | -3.0888 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.169 |
| InChI Key: | FCPGOJRHUPNBCU-UHFFFAOYSA-N |