N-{1-[(2,4-dichlorophenyl)methyl]-3-methyl-1H-pyrazol-5-yl}-4-fluorobenzamide
Chemical Structure Depiction of
N-{1-[(2,4-dichlorophenyl)methyl]-3-methyl-1H-pyrazol-5-yl}-4-fluorobenzamide
N-{1-[(2,4-dichlorophenyl)methyl]-3-methyl-1H-pyrazol-5-yl}-4-fluorobenzamide
Compound characteristics
Compound ID: | 8018-0113 |
Compound Name: | N-{1-[(2,4-dichlorophenyl)methyl]-3-methyl-1H-pyrazol-5-yl}-4-fluorobenzamide |
Molecular Weight: | 378.23 |
Molecular Formula: | C18 H14 Cl2 F N3 O |
Smiles: | Cc1cc(NC(c2ccc(cc2)F)=O)n(Cc2ccc(cc2[Cl])[Cl])n1 |
Stereo: | ACHIRAL |
logP: | 4.5878 |
logD: | 4.5715 |
logSw: | -4.601 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 37.435 |
InChI Key: | MQEKOCRXJYSGFL-UHFFFAOYSA-N |