N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoacetamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoacetamide
N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoacetamide
Compound characteristics
| Compound ID: | E136-2196 |
| Compound Name: | N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoacetamide |
| Molecular Weight: | 432.93 |
| Molecular Formula: | C20 H21 Cl N4 O3 S |
| Smiles: | Cc1cc(C(C(Nc2nnc(Cc3ccc(cc3)[Cl])s2)=O)=O)c(C)n1CCOC |
| Stereo: | ACHIRAL |
| logP: | 3.7282 |
| logD: | 3.5331 |
| logSw: | -4.2635 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.351 |
| InChI Key: | DZCVANMSGBEMAC-UHFFFAOYSA-N |