6-amino-4-(5-{[(2,5-dichlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-(5-{[(2,5-dichlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-(5-{[(2,5-dichlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 4815-0056 |
| Compound Name: | 6-amino-4-(5-{[(2,5-dichlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 471.41 |
| Molecular Formula: | C23 H20 Cl2 N4 O S |
| Smiles: | Cc1cc(C)c(cc1CSc1cc(ccc1[Cl])[Cl])C1C(C#N)=C(N)Oc2c1c(C)[nH]n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8213 |
| logD: | 5.8213 |
| logSw: | -6.0349 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.28 |
| InChI Key: | HRTKPJKPKJFCGQ-NRFANRHFSA-N |