5-(2-methylpropyl)-N-(3-{[(pyridin-3-yl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(2-methylpropyl)-N-(3-{[(pyridin-3-yl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
5-(2-methylpropyl)-N-(3-{[(pyridin-3-yl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F854-0717 |
| Compound Name: | 5-(2-methylpropyl)-N-(3-{[(pyridin-3-yl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C20 H21 N5 O2 S |
| Smiles: | CC(C)Cc1nnc(C(Nc2cccc(c2)C(NCc2cccnc2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.8628 |
| logD: | 2.8626 |
| logSw: | -3.1625 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.26 |
| InChI Key: | MLYVHLYJEOTZRD-UHFFFAOYSA-N |