6-amino-4-{2-[(3-fluorophenyl)methoxy]-5-nitrophenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-{2-[(3-fluorophenyl)methoxy]-5-nitrophenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-{2-[(3-fluorophenyl)methoxy]-5-nitrophenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 4487-0791 |
| Compound Name: | 6-amino-4-{2-[(3-fluorophenyl)methoxy]-5-nitrophenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 421.39 |
| Molecular Formula: | C21 H16 F N5 O4 |
| Smiles: | Cc1c2C(C(C#N)=C(N)Oc2[nH]n1)c1cc(ccc1OCc1cccc(c1)F)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4519 |
| logD: | 3.4519 |
| logSw: | -3.9418 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 111.247 |
| InChI Key: | ZFQUDLRFYKKHKP-IBGZPJMESA-N |