N-[(2-chlorophenyl)methyl]-3-methyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-3-methyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
N-[(2-chlorophenyl)methyl]-3-methyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0057 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-3-methyl-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 550 |
| Molecular Formula: | C21 H26 Cl N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1cccc(c1)C(N(CCS(N1CCNCC1)(=O)=O)Cc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2139 |
| logD: | 1.8692 |
| logSw: | -3.3549 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.994 |
| InChI Key: | XECFWNIEAMJETO-UHFFFAOYSA-N |