3-(adamantan-1-yl)-6-amino-4-(3,4-dimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
3-(adamantan-1-yl)-6-amino-4-(3,4-dimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
3-(adamantan-1-yl)-6-amino-4-(3,4-dimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 8012-5703 |
| Compound Name: | 3-(adamantan-1-yl)-6-amino-4-(3,4-dimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C25 H28 N4 O3 |
| Smiles: | COc1ccc(cc1OC)C1C(C#N)=C(N)Oc2c1c(C13CC4CC(CC(C4)C3)C1)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2808 |
| logD: | 4.2808 |
| logSw: | -4.6102 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.767 |
| InChI Key: | QPBVCTPXAOEONT-OKQOGFBXSA-N |