Nalpha-(4-chloro-3-nitrobenzoyl)-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]phenylalaninamide
Chemical Structure Depiction of
Nalpha-(4-chloro-3-nitrobenzoyl)-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]phenylalaninamide
Nalpha-(4-chloro-3-nitrobenzoyl)-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]phenylalaninamide
Compound characteristics
| Compound ID: | V025-1867 |
| Compound Name: | Nalpha-(4-chloro-3-nitrobenzoyl)-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]phenylalaninamide |
| Molecular Weight: | 542.4 |
| Molecular Formula: | C24 H17 Cl2 N5 O4 S |
| Salt: | not_available |
| Smiles: | C(C(C(Nc1nnc(c2cccc(c2)[Cl])s1)=O)NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6899 |
| logD: | 5.6891 |
| logSw: | -5.9627 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.727 |
| InChI Key: | FFCJGKNIBBEHFF-IBGZPJMESA-N |