N-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-4-methyl-N-[(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-4-methyl-N-[(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)methyl]benzene-1-sulfonamide
N-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-4-methyl-N-[(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8005-2675 |
| Compound Name: | N-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-4-methyl-N-[(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 531.61 |
| Molecular Formula: | C22 H25 N7 O5 S2 |
| Smiles: | Cc1ccc(cc1)S(N(CN1C(c2ccccc2S1(=O)=O)=O)c1nc(nc(n1)N(C)C)N(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8142 |
| logD: | 3.8136 |
| logSw: | -3.9665 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 110.688 |
| InChI Key: | AFQGBQKOVKFBMT-UHFFFAOYSA-N |