2-(2-chloro-4-nitrobenzene-1-sulfonyl)-1,3-benzothiazole
Chemical Structure Depiction of
2-(2-chloro-4-nitrobenzene-1-sulfonyl)-1,3-benzothiazole
2-(2-chloro-4-nitrobenzene-1-sulfonyl)-1,3-benzothiazole
Compound characteristics
| Compound ID: | 0180-0367 |
| Compound Name: | 2-(2-chloro-4-nitrobenzene-1-sulfonyl)-1,3-benzothiazole |
| Molecular Weight: | 354.79 |
| Molecular Formula: | C13 H7 Cl N2 O4 S2 |
| Smiles: | c1ccc2c(c1)nc(s2)S(c1ccc(cc1[Cl])[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9787 |
| logD: | 3.9787 |
| logSw: | -4.4081 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.616 |
| InChI Key: | LHGRVPKZXRERHS-UHFFFAOYSA-N |