5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-0899 |
| Compound Name: | 5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 386.43 |
| Molecular Formula: | C17 H18 N6 O3 S |
| Smiles: | Cc1c(CNC(COCc2nnc(C(Nc3ccccc3)=O)s2)=O)c[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 0.8527 |
| logD: | 0.8526 |
| logSw: | -2.1961 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.231 |
| InChI Key: | WBNCHIICWMJOSR-UHFFFAOYSA-N |