4-[6-amino-5-cyano-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2,6-dimethoxyphenyl acetate
Chemical Structure Depiction of
4-[6-amino-5-cyano-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2,6-dimethoxyphenyl acetate
4-[6-amino-5-cyano-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2,6-dimethoxyphenyl acetate
Compound characteristics
| Compound ID: | 3394-0129 |
| Compound Name: | 4-[6-amino-5-cyano-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2,6-dimethoxyphenyl acetate |
| Molecular Weight: | 522.51 |
| Molecular Formula: | C26 H26 N4 O8 |
| Smiles: | CC(=O)Oc1c(cc(cc1OC)C1C(C#N)=C(N)Oc2c1c(c1cc(c(c(c1)OC)OC)OC)n[nH]2)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1823 |
| logD: | 2.1823 |
| logSw: | -2.6078 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 129.636 |
| InChI Key: | MSANEFHPGMFNHN-FQEVSTJZSA-N |