N-(2H-1,3-benzodioxol-5-yl)-5-(1-pentanoylpyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-(1-pentanoylpyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-(1-pentanoylpyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F792-1551 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-(1-pentanoylpyrrolidin-2-yl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 402.47 |
Molecular Formula: | C19 H22 N4 O4 S |
Smiles: | CCCCC(N1CCCC1c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.7913 |
logD: | 2.7904 |
logSw: | -3.3495 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.13 |
InChI Key: | PZNMGCXKXCKWBM-ZDUSSCGKSA-N |