N-(3-fluorophenyl)-5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(3-fluorophenyl)-5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-1095 |
| Compound Name: | N-(3-fluorophenyl)-5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 404.42 |
| Molecular Formula: | C17 H17 F N6 O3 S |
| Smiles: | Cc1c(CNC(COCc2nnc(C(Nc3cccc(c3)F)=O)s2)=O)c[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 1.1978 |
| logD: | 1.1945 |
| logSw: | -2.3997 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.231 |
| InChI Key: | AIXWDJWUJOEHKJ-UHFFFAOYSA-N |