N-[(4-ethylphenyl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]thiophene-2-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]thiophene-2-sulfonamide--trifluoroacetic acid (1/1)
N-[(4-ethylphenyl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]thiophene-2-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0846 |
| Compound Name: | N-[(4-ethylphenyl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]thiophene-2-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 521.58 |
| Molecular Formula: | C19 H25 N3 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | CCc1ccc(CN(CC(N2CCNCC2)=O)S(c2cccs2)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9681 |
| logD: | 1.4086 |
| logSw: | -2.6003 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.714 |
| InChI Key: | HEVQMKJOWJTPBE-UHFFFAOYSA-N |