N-(3-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamoyl}phenyl)-5-methyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamoyl}phenyl)-5-methyl-1,3,4-thiadiazole-2-carboxamide
N-(3-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamoyl}phenyl)-5-methyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F854-0400 |
Compound Name: | N-(3-{[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]carbamoyl}phenyl)-5-methyl-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 412.51 |
Molecular Formula: | C20 H24 N6 O2 S |
Smiles: | CCn1c(C)c(CCNC(c2cccc(c2)NC(c2nnc(C)s2)=O)=O)c(C)n1 |
Stereo: | ACHIRAL |
logP: | 1.5788 |
logD: | 1.5781 |
logSw: | -2.4984 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 85.173 |
InChI Key: | YETSZRXSILNSLY-UHFFFAOYSA-N |