N-[5-(4-chlorophenyl)-1,3,5-triazinan-2-ylidene]-4-methyl-3-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[5-(4-chlorophenyl)-1,3,5-triazinan-2-ylidene]-4-methyl-3-nitrobenzene-1-sulfonamide
N-[5-(4-chlorophenyl)-1,3,5-triazinan-2-ylidene]-4-methyl-3-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 1954-0023 |
| Compound Name: | N-[5-(4-chlorophenyl)-1,3,5-triazinan-2-ylidene]-4-methyl-3-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 409.85 |
| Molecular Formula: | C16 H16 Cl N5 O4 S |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)S(N=C1NCN(CN1)c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6143 |
| logD: | 3.6143 |
| logSw: | -3.9642 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.527 |
| InChI Key: | RCRFNFVQFIEEQR-UHFFFAOYSA-N |