3-chloro-N-[2-(diethylamino)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-chloro-N-[2-(diethylamino)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
3-chloro-N-[2-(diethylamino)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0215 |
| Compound Name: | 3-chloro-N-[2-(diethylamino)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 545.02 |
| Molecular Formula: | C19 H31 Cl N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCN(CC)CCN(CCS(N1CCNCC1)(=O)=O)C(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.0386 |
| logD: | 0.3445 |
| logSw: | -2.839 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.655 |
| InChI Key: | SVBCCRXUNWOOFN-UHFFFAOYSA-N |