N-(2-methylpropyl)-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(2-methylpropyl)-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
N-(2-methylpropyl)-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-1102 |
| Compound Name: | N-(2-methylpropyl)-4-(piperazin-1-yl)-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 536.59 |
| Molecular Formula: | C19 H26 N4 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | CC(C)CNC(c1ccc(c(c1)NS(c1cccs1)(=O)=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.27 |
| logD: | 2.27 |
| logSw: | -3.0229 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.006 |
| InChI Key: | YDXVGQIEVFTEQP-UHFFFAOYSA-N |