N-(2H-1,3-benzodioxol-5-yl)-5-{4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-{4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-1,3,4-thiadiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-{4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F865-0675 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-{4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 499.59 |
| Molecular Formula: | C24 H29 N5 O5 S |
| Smiles: | CC1CCN(CC1)C(CC1CCN(CC1)C(c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.803 |
| logD: | 2.7883 |
| logSw: | -3.4638 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.718 |
| InChI Key: | PVRQUJFOYPHUDP-UHFFFAOYSA-N |