1-cyclohexyl-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-oxopyrrolidine-3-carboxamide
Chemical Structure Depiction of
1-cyclohexyl-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-oxopyrrolidine-3-carboxamide
1-cyclohexyl-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-oxopyrrolidine-3-carboxamide
Compound characteristics
Compound ID: | Y031-2015 |
Compound Name: | 1-cyclohexyl-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-oxopyrrolidine-3-carboxamide |
Molecular Weight: | 414.53 |
Molecular Formula: | C21 H26 N4 O3 S |
Smiles: | COc1ccc(Cc2nnc(NC(C3CC(N(C3)C3CCCCC3)=O)=O)s2)cc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.2825 |
logD: | 3.2053 |
logSw: | -3.4436 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.225 |
InChI Key: | OVCCTTRCNRHXEE-HNNXBMFYSA-N |