N-{[5-(4-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-{[5-(4-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]thiophene-2-carboxamide
N-{[5-(4-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]thiophene-2-carboxamide
Compound characteristics
Compound ID: | V002-0833 |
Compound Name: | N-{[5-(4-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]thiophene-2-carboxamide |
Molecular Weight: | 508.04 |
Molecular Formula: | C27 H26 Cl N3 O3 S |
Salt: | not_available |
Smiles: | Cn1c(c(CN(CC2CCCO2)C(c2cccs2)=O)c(c2ccccc2)n1)Oc1ccc(cc1)[Cl] |
Stereo: | RACEMIC MIXTURE |
logP: | 5.1703 |
logD: | 5.1703 |
logSw: | -5.6848 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 46.876 |
InChI Key: | UHFCYTNKFRFRFF-JOCHJYFZSA-N |