N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-octanoylprolinamide
Chemical Structure Depiction of
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-octanoylprolinamide
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-octanoylprolinamide
Compound characteristics
| Compound ID: | V005-1634 |
| Compound Name: | N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-octanoylprolinamide |
| Molecular Weight: | 479.44 |
| Molecular Formula: | C21 H27 Br N4 O2 S |
| Smiles: | CCCCCCCC(N1CCCC1C(Nc1nnc(c2ccc(cc2)[Br])s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8504 |
| logD: | 5.8497 |
| logSw: | -5.3116 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.055 |
| InChI Key: | HMBIXQMOHVIMRL-KRWDZBQOSA-N |