N-[2-(dimethylamino)ethyl]-N-ethyl-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-N-ethyl-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
N-[2-(dimethylamino)ethyl]-N-ethyl-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0281 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-N-ethyl-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 579.66 |
| Molecular Formula: | C21 H31 N5 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | CCN(CCN(C)C)C(c1ccc(c(c1)NS(c1cccs1)(=O)=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5329 |
| logD: | 1.5329 |
| logSw: | -2.5573 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.372 |
| InChI Key: | GXLQQDUHQITCRA-UHFFFAOYSA-N |