ethyl 1-methyl-3-{[2-(phenylsulfanyl)phenyl]carbamoyl}-1H-pyrazole-5-carboxylate
Chemical Structure Depiction of
ethyl 1-methyl-3-{[2-(phenylsulfanyl)phenyl]carbamoyl}-1H-pyrazole-5-carboxylate
ethyl 1-methyl-3-{[2-(phenylsulfanyl)phenyl]carbamoyl}-1H-pyrazole-5-carboxylate
Compound characteristics
Compound ID: | Y501-5464 |
Compound Name: | ethyl 1-methyl-3-{[2-(phenylsulfanyl)phenyl]carbamoyl}-1H-pyrazole-5-carboxylate |
Molecular Weight: | 381.45 |
Molecular Formula: | C20 H19 N3 O3 S |
Smiles: | CCOC(c1cc(C(Nc2ccccc2Sc2ccccc2)=O)nn1C)=O |
Stereo: | ACHIRAL |
logP: | 3.5737 |
logD: | 3.5737 |
logSw: | -3.7874 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.63 |
InChI Key: | GHZPUOSBXKNVRI-UHFFFAOYSA-N |