1-[5-(2,4-dimethylphenyl)-3-(2-fluorophenyl)-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-(2,4-dimethylphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
1-[5-(2,4-dimethylphenyl)-3-(2-fluorophenyl)-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: | V005-7623 |
| Compound Name: | 1-[5-(2,4-dimethylphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one |
| Molecular Weight: | 451.54 |
| Molecular Formula: | C26 H30 F N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C2CC(c3ccccc3F)=NN2C(CN2CCC3(CC2)OCCO3)=O)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3618 |
| logD: | 4.312 |
| logSw: | -4.2814 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.028 |
| InChI Key: | QKJDYTFSXBKXNI-XMMPIXPASA-N |