5-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F865-0552 |
| Compound Name: | 5-[4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 507.57 |
| Molecular Formula: | C25 H25 N5 O5 S |
| Smiles: | C1CN(CCC1CC(NCc1ccc2c(c1)OCO2)=O)C(c1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.716 |
| logD: | 2.7152 |
| logSw: | -3.3555 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.797 |
| InChI Key: | RNXZBSAEZAQFAN-UHFFFAOYSA-N |