4-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-(2-methoxy-5-methylphenyl)piperidine-1-carboxamide
Chemical Structure Depiction of
4-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-(2-methoxy-5-methylphenyl)piperidine-1-carboxamide
4-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-(2-methoxy-5-methylphenyl)piperidine-1-carboxamide
Compound characteristics
| Compound ID: | L077-0735 |
| Compound Name: | 4-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-(2-methoxy-5-methylphenyl)piperidine-1-carboxamide |
| Molecular Weight: | 495.56 |
| Molecular Formula: | C24 H25 N5 O5 S |
| Smiles: | Cc1ccc(c(c1)NC(N1CCC(CC1)c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.5405 |
| logD: | 3.5396 |
| logSw: | -3.5822 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.079 |
| InChI Key: | GSJDXHODZCMUQK-UHFFFAOYSA-N |