6-amino-4-{3-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-{3-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-{3-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 4303-0820 |
| Compound Name: | 6-amino-4-{3-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 450.92 |
| Molecular Formula: | C24 H23 Cl N4 O3 |
| Smiles: | Cc1cc(cc(C)c1[Cl])OCc1cc(ccc1OC)C1C(C#N)=C(N)Oc2c1c(C)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4681 |
| logD: | 4.4681 |
| logSw: | -4.794 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.409 |
| InChI Key: | NNFQAWQBFIWOSQ-NRFANRHFSA-N |