1-butyl-N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-5-oxopyrrolidine-3-carboxamide
Chemical Structure Depiction of
1-butyl-N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-5-oxopyrrolidine-3-carboxamide
1-butyl-N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-5-oxopyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | Y031-4977 |
| Compound Name: | 1-butyl-N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-5-oxopyrrolidine-3-carboxamide |
| Molecular Weight: | 408.91 |
| Molecular Formula: | C18 H21 Cl N4 O3 S |
| Smiles: | CCCCN1CC(CC1=O)C(Nc1nnc(COc2ccc(cc2)[Cl])s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0016 |
| logD: | 2.5778 |
| logSw: | -3.5106 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.043 |
| InChI Key: | OXJDGOBUJNDLMW-LBPRGKRZSA-N |