N-[2-(4-fluorophenyl)ethyl]-4-methoxy-3-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(4-fluorophenyl)ethyl]-4-methoxy-3-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]benzene-1-sulfonamide
N-[2-(4-fluorophenyl)ethyl]-4-methoxy-3-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V010-9295 |
| Compound Name: | N-[2-(4-fluorophenyl)ethyl]-4-methoxy-3-[4-(3-nitrobenzene-1-sulfonyl)piperazin-1-yl]benzene-1-sulfonamide |
| Molecular Weight: | 578.64 |
| Molecular Formula: | C25 H27 F N4 O7 S2 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1N1CCN(CC1)S(c1cccc(c1)[N+]([O-])=O)(=O)=O)S(NCCc1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1023 |
| logD: | 4.1023 |
| logSw: | -4.2824 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.521 |
| InChI Key: | CYOJVEIOMYQZKE-UHFFFAOYSA-N |