N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({5-[(4-fluorophenyl)carbamamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({5-[(4-fluorophenyl)carbamamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({5-[(4-fluorophenyl)carbamamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G856-9811 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({5-[(4-fluorophenyl)carbamamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 491.56 |
| Molecular Formula: | C21 H22 F N5 O4 S2 |
| Smiles: | COc1ccc(CCNC(CSc2nnc(NC(Nc3ccc(cc3)F)=O)s2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.3772 |
| logD: | 3.3771 |
| logSw: | -3.7517 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.75 |
| InChI Key: | CQMGTXANAGNENY-UHFFFAOYSA-N |