N,N-diethyl-3-[(4-fluorobenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N,N-diethyl-3-[(4-fluorobenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N,N-diethyl-3-[(4-fluorobenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0025 |
| Compound Name: | N,N-diethyl-3-[(4-fluorobenzene-1-sulfonyl)amino]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 548.56 |
| Molecular Formula: | C21 H27 F N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCN(CC)C(c1ccc(c(c1)NS(c1ccc(cc1)F)(=O)=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9326 |
| logD: | 1.9326 |
| logSw: | -2.9176 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.234 |
| InChI Key: | IQWDOMQQMOXPIH-UHFFFAOYSA-N |