2-[6-amino-3-(2H-1,3-benzodioxol-5-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-6-methoxyphenyl morpholine-4-carboxylate
Chemical Structure Depiction of
2-[6-amino-3-(2H-1,3-benzodioxol-5-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-6-methoxyphenyl morpholine-4-carboxylate
2-[6-amino-3-(2H-1,3-benzodioxol-5-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-6-methoxyphenyl morpholine-4-carboxylate
Compound characteristics
| Compound ID: | 3394-0369 |
| Compound Name: | 2-[6-amino-3-(2H-1,3-benzodioxol-5-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-6-methoxyphenyl morpholine-4-carboxylate |
| Molecular Weight: | 517.5 |
| Molecular Formula: | C26 H23 N5 O7 |
| Smiles: | COc1cccc(C2C(C#N)=C(N)Oc3c2c(c2ccc4c(c2)OCO4)n[nH]3)c1OC(N1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6047 |
| logD: | 2.6047 |
| logSw: | -3.2344 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 125.897 |
| InChI Key: | XZJIQYHNWOUSCB-FQEVSTJZSA-N |