1-[5-(methyl{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}amino)-1,3,4-thiadiazol-2-yl]pyrrolidin-2-one
Chemical Structure Depiction of
1-[5-(methyl{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}amino)-1,3,4-thiadiazol-2-yl]pyrrolidin-2-one
1-[5-(methyl{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}amino)-1,3,4-thiadiazol-2-yl]pyrrolidin-2-one
Compound characteristics
| Compound ID: | G397-0270 |
| Compound Name: | 1-[5-(methyl{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}amino)-1,3,4-thiadiazol-2-yl]pyrrolidin-2-one |
| Molecular Weight: | 445.5 |
| Molecular Formula: | C19 H23 N7 O4 S |
| Smiles: | CN(CC(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)c1nnc(N2CCCC2=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.7225 |
| logD: | 1.7225 |
| logSw: | -2.2771 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 96.178 |
| InChI Key: | UPBYRGIRVBDQSV-UHFFFAOYSA-N |