1-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide
1-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F864-0787 |
| Compound Name: | 1-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazole-2-carbonyl}-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide |
| Molecular Weight: | 507.57 |
| Molecular Formula: | C25 H25 N5 O5 S |
| Smiles: | Cc1ccccc1CNC(C1CCCN(C1)C(c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0838 |
| logD: | 3.0691 |
| logSw: | -3.294 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.944 |
| InChI Key: | ZLTYAMVOBSNIFM-KRWDZBQOSA-N |