4-methyl-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-methyl-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
4-methyl-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0340 |
| Compound Name: | 4-methyl-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 509.54 |
| Molecular Formula: | C19 H29 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1)C(N(CCS(N1CCNCC1)(=O)=O)CC1CCCO1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3318 |
| logD: | -0.0129 |
| logSw: | -2.1146 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.648 |
| InChI Key: | KQINKYRXYUCXCW-GOSISDBHSA-N |