6-amino-4-{4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-{4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-{4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 4487-0765 |
| Compound Name: | 6-amino-4-{4-[(2-chloro-6-fluorophenyl)methoxy]-3-ethoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 454.89 |
| Molecular Formula: | C23 H20 Cl F N4 O3 |
| Smiles: | CCOc1cc(ccc1OCc1c(cccc1[Cl])F)C1C(C#N)=C(N)Oc2c1c(C)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3993 |
| logD: | 3.3993 |
| logSw: | -4.1903 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.076 |
| InChI Key: | CVMSVUBYBLPGIC-NRFANRHFSA-N |