1-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamothioyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamothioyl}piperidine-4-carboxamide
1-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamothioyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | 5236-0109 |
| Compound Name: | 1-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamothioyl}piperidine-4-carboxamide |
| Molecular Weight: | 321.4 |
| Molecular Formula: | C15 H19 N3 O3 S |
| Smiles: | C1CN(CCC1C(N)=O)C(NCc1ccc2c(c1)OCO2)=S |
| Stereo: | ACHIRAL |
| logP: | 1.0854 |
| logD: | 1.0854 |
| logSw: | -2.313 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 63.633 |
| InChI Key: | GZHPZIVORGWFLM-UHFFFAOYSA-N |