2-(1H-benzimidazol-2-yl)-5-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-5-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
2-(1H-benzimidazol-2-yl)-5-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y021-0648 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-5-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 344.41 |
| Molecular Formula: | C14 H12 N6 O S2 |
| Smiles: | Cc1nnc(SCC2CC(N(c3nc4ccccc4[nH]3)N=2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.581 |
| logD: | 1.0387 |
| logSw: | -2.2896 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.287 |
| InChI Key: | BMQFDFNYPDRWTP-UHFFFAOYSA-N |