N-(4-methoxyphenyl)-5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-methoxyphenyl)-5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F500-0147 |
| Compound Name: | N-(4-methoxyphenyl)-5-[(2-{[(3-methyl-1H-pyrazol-4-yl)methyl]amino}-2-oxoethoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 416.46 |
| Molecular Formula: | C18 H20 N6 O4 S |
| Smiles: | Cc1c(CNC(COCc2nnc(C(Nc3ccc(cc3)OC)=O)s2)=O)c[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 1.0268 |
| logD: | 1.0267 |
| logSw: | -2.1735 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 111.775 |
| InChI Key: | GJBBPDUDZMJKKJ-UHFFFAOYSA-N |