N-[(2-chlorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
N-[(2-chlorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0066 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 535.97 |
| Molecular Formula: | C20 H24 Cl N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | C1CN(CCN1)S(CCN(Cc1ccccc1[Cl])C(c1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8218 |
| logD: | 1.4771 |
| logSw: | -2.7584 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.994 |
| InChI Key: | OZWSQBRPFHFIKE-UHFFFAOYSA-N |