N-[4-(2-{[3-nitro-4-(pyrrolidin-1-yl)phenyl]methylidene}hydrazinesulfonyl)phenyl]acetamide
Chemical Structure Depiction of
N-[4-(2-{[3-nitro-4-(pyrrolidin-1-yl)phenyl]methylidene}hydrazinesulfonyl)phenyl]acetamide
N-[4-(2-{[3-nitro-4-(pyrrolidin-1-yl)phenyl]methylidene}hydrazinesulfonyl)phenyl]acetamide
Compound characteristics
| Compound ID: | 8004-1184 |
| Compound Name: | N-[4-(2-{[3-nitro-4-(pyrrolidin-1-yl)phenyl]methylidene}hydrazinesulfonyl)phenyl]acetamide |
| Molecular Weight: | 431.47 |
| Molecular Formula: | C19 H21 N5 O5 S |
| Smiles: | CC(Nc1ccc(cc1)S(N/N=C/c1ccc(c(c1)[N+]([O-])=O)N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3091 |
| logD: | 0.9568 |
| logSw: | -2.9942 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.688 |
| InChI Key: | WQWSMHXGDUAORP-UHFFFAOYSA-N |