N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)piperidine-4-carboxamide
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L306-0569 |
| Compound Name: | N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 499.65 |
| Molecular Formula: | C18 H21 N5 O4 S4 |
| Smiles: | CCSc1nnc(NC(C2CCN(CC2)S(c2ccc3c(c2)SC(N3C)=O)(=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.655 |
| logD: | 3.6434 |
| logSw: | -3.8205 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.557 |
| InChI Key: | KUEUCJXRQWTJHI-UHFFFAOYSA-N |