1-(4-methylbenzene-1-sulfonyl)-N-{[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]methyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-(4-methylbenzene-1-sulfonyl)-N-{[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]methyl}piperidine-4-carboxamide
1-(4-methylbenzene-1-sulfonyl)-N-{[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]methyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L061-0610 |
| Compound Name: | 1-(4-methylbenzene-1-sulfonyl)-N-{[5-(phenylcarbamoyl)-1,3,4-thiadiazol-2-yl]methyl}piperidine-4-carboxamide |
| Molecular Weight: | 499.61 |
| Molecular Formula: | C23 H25 N5 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(N1CCC(CC1)C(NCc1nnc(C(Nc2ccccc2)=O)s1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.635 |
| logD: | 2.6349 |
| logSw: | -3.1488 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.453 |
| InChI Key: | OXKSJXZULWRLGK-UHFFFAOYSA-N |