6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 6049-0147 |
| Compound Name: | 6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2,4-dimethylphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 438.89 |
| Molecular Formula: | C23 H20 Cl F N4 O2 |
| Smiles: | Cc1cc(C)c(cc1COc1ccc(cc1[Cl])F)C1C(C#N)=C(N)Oc2c1c(C)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3654 |
| logD: | 4.3654 |
| logSw: | -4.4896 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.865 |
| InChI Key: | WLQHEXOSMKELMG-NRFANRHFSA-N |