1-[5-(4-chlorophenyl)-3-(3-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-[5-(4-chlorophenyl)-3-(3-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one
1-[5-(4-chlorophenyl)-3-(3-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: | V028-9804 |
Compound Name: | 1-[5-(4-chlorophenyl)-3-(3-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethan-1-one |
Molecular Weight: | 453.97 |
Molecular Formula: | C25 H28 Cl N3 O3 |
Salt: | not_available |
Smiles: | Cc1cccc(c1)C1CC(c2ccc(cc2)[Cl])N(C(CN2CCC3(CC2)OCCO3)=O)N=1 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.2781 |
logD: | 4.2283 |
logSw: | -4.7323 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 45.028 |
InChI Key: | SKRZXSBRQXKEHY-QHCPKHFHSA-N |