N-[(3-fluorophenyl)methyl]-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(3-fluorophenyl)methyl]-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
N-[(3-fluorophenyl)methyl]-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-1189 |
| Compound Name: | N-[(3-fluorophenyl)methyl]-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 588.6 |
| Molecular Formula: | C22 H23 F N4 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | C1CN(CCN1)c1ccc(cc1NS(c1cccs1)(=O)=O)C(NCc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8488 |
| logD: | 2.8488 |
| logSw: | -3.5367 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.734 |
| InChI Key: | VLCRQCJWZFWHAP-UHFFFAOYSA-N |