N-{2-oxo-2-[(1,1,3,3-tetraoxo-1,3-dihydro-2H-1lambda~6~,3lambda~6~,2-benzodithiazol-2-yl)amino]ethyl}benzamide
Chemical Structure Depiction of
N-{2-oxo-2-[(1,1,3,3-tetraoxo-1,3-dihydro-2H-1lambda~6~,3lambda~6~,2-benzodithiazol-2-yl)amino]ethyl}benzamide
N-{2-oxo-2-[(1,1,3,3-tetraoxo-1,3-dihydro-2H-1lambda~6~,3lambda~6~,2-benzodithiazol-2-yl)amino]ethyl}benzamide
Compound characteristics
| Compound ID: | R052-1721 |
| Compound Name: | N-{2-oxo-2-[(1,1,3,3-tetraoxo-1,3-dihydro-2H-1lambda~6~,3lambda~6~,2-benzodithiazol-2-yl)amino]ethyl}benzamide |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C15 H13 N3 O6 S2 |
| Smiles: | C(C(NN1S(c2ccccc2S1(=O)=O)(=O)=O)=O)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4699 |
| logD: | 0.4699 |
| logSw: | -2.1809 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.524 |
| InChI Key: | LJGPCSUVUQJWJP-UHFFFAOYSA-N |