2-(3,4-dimethylphenyl)-5-methyl-4-{[(1H-tetrazol-5-yl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-5-methyl-4-{[(1H-tetrazol-5-yl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
2-(3,4-dimethylphenyl)-5-methyl-4-{[(1H-tetrazol-5-yl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y508-0559 |
| Compound Name: | 2-(3,4-dimethylphenyl)-5-methyl-4-{[(1H-tetrazol-5-yl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 297.32 |
| Molecular Formula: | C14 H15 N7 O |
| Smiles: | CC1/C(=C/Nc2nnn[nH]2)C(N(c2ccc(C)c(C)c2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.681 |
| logD: | 0.0991 |
| logSw: | -2.2295 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.706 |
| InChI Key: | SLTPSINWAKAGQF-UHFFFAOYSA-N |