N-[2-(dimethylamino)ethyl]-3,4,5-trimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-3,4,5-trimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
N-[2-(dimethylamino)ethyl]-3,4,5-trimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F594-0166 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-3,4,5-trimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 536.55 |
| Molecular Formula: | C21 H34 N4 O5 |
| Salt: | CF3COOH |
| Smiles: | CN(C)CCN(CCC(N1CCNCC1)=O)C(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | -0.6815 |
| logD: | -1.5095 |
| logSw: | -1.1505 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.603 |
| InChI Key: | GSVDFPVUXHGLPN-UHFFFAOYSA-N |