N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Chemical Structure Depiction of
N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Compound characteristics
| Compound ID: | Y042-3848 |
| Compound Name: | N-(5-propyl-1,3,4-thiadiazol-2-yl)-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide |
| Molecular Weight: | 369.46 |
| Molecular Formula: | C17 H15 N5 O S2 |
| Smiles: | CCCc1nnc(NC(c2ccc3c(c2)sc(n3)n2cccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.8635 |
| logD: | 4.224 |
| logSw: | -4.6047 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.891 |
| InChI Key: | PXBMXGCULANREY-UHFFFAOYSA-N |