N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-Nalpha-(butylcarbamoyl)phenylalaninamide
Chemical Structure Depiction of
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-Nalpha-(butylcarbamoyl)phenylalaninamide
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-Nalpha-(butylcarbamoyl)phenylalaninamide
Compound characteristics
| Compound ID: | V017-5691 |
| Compound Name: | N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-Nalpha-(butylcarbamoyl)phenylalaninamide |
| Molecular Weight: | 502.43 |
| Molecular Formula: | C22 H24 Br N5 O2 S |
| Salt: | not_available |
| Smiles: | CCCCNC(NC(Cc1ccccc1)C(Nc1nnc(c2ccc(cc2)[Br])s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3122 |
| logD: | 5.3116 |
| logSw: | -5.1973 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.294 |
| InChI Key: | LRQHMGLLGDPOMT-SFHVURJKSA-N |