2-[4-bromo-2-(2-chlorobenzoyl)anilino]-N,N,N-trimethyl-2-oxoethan-1-aminium--bromide (1/1)
Chemical Structure Depiction of
2-[4-bromo-2-(2-chlorobenzoyl)anilino]-N,N,N-trimethyl-2-oxoethan-1-aminium--bromide (1/1)
2-[4-bromo-2-(2-chlorobenzoyl)anilino]-N,N,N-trimethyl-2-oxoethan-1-aminium--bromide (1/1)
Compound characteristics
| Compound ID: | 0831-1186 |
| Compound Name: | 2-[4-bromo-2-(2-chlorobenzoyl)anilino]-N,N,N-trimethyl-2-oxoethan-1-aminium--bromide (1/1) |
| Molecular Weight: | 490.62 |
| Molecular Formula: | C18 H19 Br Cl N2 O2 |
| Salt: | Br- |
| Smiles: | C[N+](C)(C)CC(Nc1ccc(cc1C(c1ccccc1[Cl])=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9586 |
| logD: | 3.5405 |
| logSw: | -4.1909 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.746 |
| InChI Key: | GHNKRRRLBVSGTO-UHFFFAOYSA-O |