N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-Nalpha-(4-methyl-3-nitrobenzoyl)phenylalaninamide
Chemical Structure Depiction of
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-Nalpha-(4-methyl-3-nitrobenzoyl)phenylalaninamide
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-Nalpha-(4-methyl-3-nitrobenzoyl)phenylalaninamide
Compound characteristics
| Compound ID: | V023-2575 |
| Compound Name: | N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-Nalpha-(4-methyl-3-nitrobenzoyl)phenylalaninamide |
| Molecular Weight: | 566.43 |
| Molecular Formula: | C25 H20 Br N5 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(NC(Cc1ccccc1)C(Nc1nnc(c2ccc(cc2)[Br])s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0133 |
| logD: | 6.0128 |
| logSw: | -5.4863 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.727 |
| InChI Key: | HLVXMXIUXMAXBY-FQEVSTJZSA-N |