1-{2-[1-(2-phenoxyethyl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]pyrrolidin-1-yl}butan-1-one
Chemical Structure Depiction of
1-{2-[1-(2-phenoxyethyl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]pyrrolidin-1-yl}butan-1-one
1-{2-[1-(2-phenoxyethyl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]pyrrolidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S893-0687 |
| Compound Name: | 1-{2-[1-(2-phenoxyethyl)-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl]pyrrolidin-1-yl}butan-1-one |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C22 H29 N3 O3 |
| Smiles: | CCCC(N1CCCC1c1c2COCCc2n(CCOc2ccccc2)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1387 |
| logD: | 3.1387 |
| logSw: | -3.1164 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.603 |
| InChI Key: | XHHSMPMDYKFUNV-FQEVSTJZSA-N |