4-(4-methyl-3-nitrobenzene-1-sulfonyl)-N'-nitropiperazine-1-carboximidamide
Chemical Structure Depiction of
4-(4-methyl-3-nitrobenzene-1-sulfonyl)-N'-nitropiperazine-1-carboximidamide
4-(4-methyl-3-nitrobenzene-1-sulfonyl)-N'-nitropiperazine-1-carboximidamide
Compound characteristics
| Compound ID: | 4877-0066 |
| Compound Name: | 4-(4-methyl-3-nitrobenzene-1-sulfonyl)-N'-nitropiperazine-1-carboximidamide |
| Molecular Weight: | 372.36 |
| Molecular Formula: | C12 H16 N6 O6 S |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)S(N1CCN(CC1)C(\N)=N/[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8473 |
| logD: | 0.1978 |
| logSw: | -2.3091 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 133.161 |
| InChI Key: | XRKNWYLXNFQEQY-UHFFFAOYSA-N |