N-{4-[4-(3-{[(furan-2-yl)methyl]amino}-4-nitrophenyl)piperazine-1-sulfonyl]phenyl}acetamide
Chemical Structure Depiction of
N-{4-[4-(3-{[(furan-2-yl)methyl]amino}-4-nitrophenyl)piperazine-1-sulfonyl]phenyl}acetamide
N-{4-[4-(3-{[(furan-2-yl)methyl]amino}-4-nitrophenyl)piperazine-1-sulfonyl]phenyl}acetamide
Compound characteristics
| Compound ID: | 4299-1909 |
| Compound Name: | N-{4-[4-(3-{[(furan-2-yl)methyl]amino}-4-nitrophenyl)piperazine-1-sulfonyl]phenyl}acetamide |
| Molecular Weight: | 499.54 |
| Molecular Formula: | C23 H25 N5 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1031 |
| logD: | 3.1028 |
| logSw: | -3.6757 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.838 |
| InChI Key: | BVTBYJOSUFHCGJ-UHFFFAOYSA-N |