1-[5-(2,5-dimethylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
Chemical Structure Depiction of
1-[5-(2,5-dimethylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
1-[5-(2,5-dimethylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
Compound characteristics
| Compound ID: | V022-8958 |
| Compound Name: | 1-[5-(2,5-dimethylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C26 H31 N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C)c(c1)C1CC(c2ccccc2)=NN1C(CN1CCC2(CC1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2032 |
| logD: | 4.1534 |
| logSw: | -4.1503 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.028 |
| InChI Key: | VGMODMQKDOGVBT-DEOSSOPVSA-N |