1-[3-(2,4-dimethylphenyl)-5-(2-methylphenyl)-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-[3-(2,4-dimethylphenyl)-5-(2-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
1-[3-(2,4-dimethylphenyl)-5-(2-methylphenyl)-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: | V016-9842 |
| Compound Name: | 1-[3-(2,4-dimethylphenyl)-5-(2-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C27 H33 N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(C2CC(c3ccccc3C)N(C(CN3CCC4(CC3)OCCO4)=O)N=2)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6593 |
| logD: | 4.6095 |
| logSw: | -4.3059 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.028 |
| InChI Key: | FUNUZCULJDXLKZ-VWLOTQADSA-N |