N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-N~2~-[4-(propan-2-yl)phenyl]-N~2~-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycinamide
Chemical Structure Depiction of
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-N~2~-[4-(propan-2-yl)phenyl]-N~2~-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycinamide
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-N~2~-[4-(propan-2-yl)phenyl]-N~2~-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycinamide
Compound characteristics
| Compound ID: | C626-0177 |
| Compound Name: | N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-N~2~-[4-(propan-2-yl)phenyl]-N~2~-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycinamide |
| Molecular Weight: | 508.68 |
| Molecular Formula: | C21 H28 N6 O3 S3 |
| Smiles: | CCSc1nnc(NC(CN(c2ccc(cc2)C(C)C)S(c2c(C)nn(C)c2C)(=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.9 |
| logD: | 3.8975 |
| logSw: | -3.7924 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.687 |
| InChI Key: | QRJLREZHWNMFEF-UHFFFAOYSA-N |