N-(2-methylphenyl)-5-({[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2-methylphenyl)-5-({[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide
N-(2-methylphenyl)-5-({[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F499-1087 |
Compound Name: | N-(2-methylphenyl)-5-({[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}methyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 376.5 |
Molecular Formula: | C17 H20 N4 O2 S2 |
Smiles: | Cc1ccccc1NC(c1nnc(CSCC(N2CCCC2)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 2.5249 |
logD: | 2.5248 |
logSw: | -2.6553 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.118 |
InChI Key: | SMQJAUYZAQJQAG-UHFFFAOYSA-N |