2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-[5-(4-ethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-[5-(4-ethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-[5-(4-ethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V018-0607 |
| Compound Name: | 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-[5-(4-ethoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 463.58 |
| Molecular Formula: | C27 H33 N3 O4 |
| Salt: | not_available |
| Smiles: | CCOc1ccc(cc1)C1CC(c2ccc(C)cc2)=NN1C(CN1CCC2(CC1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1305 |
| logD: | 4.0807 |
| logSw: | -3.9506 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.152 |
| InChI Key: | OQJGUYYUMFLWCH-VWLOTQADSA-N |