N-(2-methoxyethyl)-5-[(2-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(2-methoxyethyl)-5-[(2-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-(2-methoxyethyl)-5-[(2-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L268-0559 |
| Compound Name: | N-(2-methoxyethyl)-5-[(2-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 546.56 |
| Molecular Formula: | C21 H28 N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccccc1S(Nc1ccc(c(c1)C(NCCOC)=O)N1CCNCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9196 |
| logD: | 0.4441 |
| logSw: | -2.8852 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.869 |
| InChI Key: | VPFNSPXQNJRVKG-UHFFFAOYSA-N |