[1-(2-fluorophenyl)-5-(4-methoxyphenyl)-2-methyl-1H-pyrrol-3-yl][4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[1-(2-fluorophenyl)-5-(4-methoxyphenyl)-2-methyl-1H-pyrrol-3-yl][4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl]methanone
[1-(2-fluorophenyl)-5-(4-methoxyphenyl)-2-methyl-1H-pyrrol-3-yl][4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | V008-8630 |
| Compound Name: | [1-(2-fluorophenyl)-5-(4-methoxyphenyl)-2-methyl-1H-pyrrol-3-yl][4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl]methanone |
| Molecular Weight: | 578.62 |
| Molecular Formula: | C29 H27 F N4 O6 S |
| Smiles: | Cc1c(cc(c2ccc(cc2)OC)n1c1ccccc1F)C(N1CCN(CC1)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8937 |
| logD: | 4.8937 |
| logSw: | -4.6711 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 90.453 |
| InChI Key: | YFWBFNOEMVZERS-UHFFFAOYSA-N |