2-[4-bromo-2-(4-chlorobenzoyl)anilino]-N,N,N-triethyl-2-oxoethan-1-aminium--bromide (1/1)
Chemical Structure Depiction of
2-[4-bromo-2-(4-chlorobenzoyl)anilino]-N,N,N-triethyl-2-oxoethan-1-aminium--bromide (1/1)
2-[4-bromo-2-(4-chlorobenzoyl)anilino]-N,N,N-triethyl-2-oxoethan-1-aminium--bromide (1/1)
Compound characteristics
| Compound ID: | 0831-1189 |
| Compound Name: | 2-[4-bromo-2-(4-chlorobenzoyl)anilino]-N,N,N-triethyl-2-oxoethan-1-aminium--bromide (1/1) |
| Molecular Weight: | 532.7 |
| Molecular Formula: | C21 H25 Br Cl N2 O2 |
| Salt: | Br- |
| Smiles: | CC[N+](CC)(CC)CC(Nc1ccc(cc1C(c1ccc(cc1)[Cl])=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1349 |
| logD: | 5.0608 |
| logSw: | -5.4275 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.14 |
| InChI Key: | OEUDBVYPRSYJAO-UHFFFAOYSA-O |