6-amino-3-(3,4-dichlorophenyl)-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-3-(3,4-dichlorophenyl)-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-3-(3,4-dichlorophenyl)-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 8012-0134 |
| Compound Name: | 6-amino-3-(3,4-dichlorophenyl)-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 467.29 |
| Molecular Formula: | C22 H13 Cl2 F N6 O |
| Smiles: | C(C1C(c2c[nH]nc2c2ccc(cc2)F)c2c(c3ccc(c(c3)[Cl])[Cl])n[nH]c2OC=1N)#N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4738 |
| logD: | 3.8262 |
| logSw: | -4.6995 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 94.663 |
| InChI Key: | XBWVLMJAYBFUJU-KRWDZBQOSA-N |