N-{4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-oxobutanoyl}-L-valine
Chemical Structure Depiction of
N-{4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-oxobutanoyl}-L-valine
N-{4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-oxobutanoyl}-L-valine
Compound characteristics
| Compound ID: | Y044-0634 |
| Compound Name: | N-{4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-oxobutanoyl}-L-valine |
| Molecular Weight: | 443.49 |
| Molecular Formula: | C19 H26 F N3 O6 S |
| Smiles: | CC(C)[C@@H](C(O)=O)NC(CCC(N1CCN(CC1)S(c1ccc(cc1)F)(=O)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.7373 |
| logD: | -4.3244 |
| logSw: | -2.1902 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.381 |
| InChI Key: | CZOQRVZEXJNJQT-SFHVURJKSA-N |