3-[(4-tert-butylbenzene-1-sulfonyl)amino]-N-ethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(4-tert-butylbenzene-1-sulfonyl)amino]-N-ethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
3-[(4-tert-butylbenzene-1-sulfonyl)amino]-N-ethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-1004 |
| Compound Name: | 3-[(4-tert-butylbenzene-1-sulfonyl)amino]-N-ethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 558.62 |
| Molecular Formula: | C23 H32 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCNC(c1ccc(c(c1)NS(c1ccc(cc1)C(C)(C)C)(=O)=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3555 |
| logD: | 3.3555 |
| logSw: | -3.7883 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.613 |
| InChI Key: | OPPGBIXFWZMWSG-UHFFFAOYSA-N |