2-(3-chlorophenyl)-1H-1lambda~6~,3lambda~6~,2-benzodithiazole-1,1,3,3(2H)-tetrone
Chemical Structure Depiction of
2-(3-chlorophenyl)-1H-1lambda~6~,3lambda~6~,2-benzodithiazole-1,1,3,3(2H)-tetrone
2-(3-chlorophenyl)-1H-1lambda~6~,3lambda~6~,2-benzodithiazole-1,1,3,3(2H)-tetrone
Compound characteristics
| Compound ID: | K509-0033 |
| Compound Name: | 2-(3-chlorophenyl)-1H-1lambda~6~,3lambda~6~,2-benzodithiazole-1,1,3,3(2H)-tetrone |
| Molecular Weight: | 329.78 |
| Molecular Formula: | C12 H8 Cl N O4 S2 |
| Smiles: | c1ccc2c(c1)S(N(c1cccc(c1)[Cl])S2(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5969 |
| logD: | 2.5969 |
| logSw: | -3.1418 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.941 |
| InChI Key: | MLYOVPFPLBBVMT-UHFFFAOYSA-N |