6-amino-3-(3,4-dichlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-3-(3,4-dichlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-3-(3,4-dichlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 8012-0222 |
| Compound Name: | 6-amino-3-(3,4-dichlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 488.29 |
| Molecular Formula: | C21 H15 Cl2 N5 O5 |
| Smiles: | CCOc1cc(cc(c1O)[N+]([O-])=O)C1C(C#N)=C(N)Oc2c1c(c1ccc(c(c1)[Cl])[Cl])n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6006 |
| logD: | 4.0949 |
| logSw: | -4.6674 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 126.243 |
| InChI Key: | MVFGQGIBPPACDD-INIZCTEOSA-N |