N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(2-phenylpropyl)thiophene-2-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(2-phenylpropyl)thiophene-2-sulfonamide--trifluoroacetic acid (1/1)
N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(2-phenylpropyl)thiophene-2-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0728 |
| Compound Name: | N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(2-phenylpropyl)thiophene-2-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 535.6 |
| Molecular Formula: | C20 H27 N3 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | CC(CN(CCC(N1CCNCC1)=O)S(c1cccs1)(=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.232 |
| logD: | 1.4041 |
| logSw: | -2.6702 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.692 |
| InChI Key: | YZULPJRCEMQHBO-KRWDZBQOSA-N |