5-{4-[2-(azepan-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{4-[2-(azepan-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
5-{4-[2-(azepan-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F865-0764 |
| Compound Name: | 5-{4-[2-(azepan-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C24 H31 N5 O4 S |
| Smiles: | COc1ccc(cc1)NC(c1nnc(C(N2CCC(CC2)CC(N2CCCCCC2)=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1178 |
| logD: | 3.1163 |
| logSw: | -3.5497 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.478 |
| InChI Key: | XYTBVATUYMARLR-UHFFFAOYSA-N |