2-[2-hydroxy-3-(4-nitrophenoxy)propyl]-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
Chemical Structure Depiction of
2-[2-hydroxy-3-(4-nitrophenoxy)propyl]-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
2-[2-hydroxy-3-(4-nitrophenoxy)propyl]-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
Compound characteristics
| Compound ID: | 3773-0920 |
| Compound Name: | 2-[2-hydroxy-3-(4-nitrophenoxy)propyl]-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione |
| Molecular Weight: | 378.36 |
| Molecular Formula: | C16 H14 N2 O7 S |
| Smiles: | C(C(COc1ccc(cc1)[N+]([O-])=O)O)N1C(c2ccccc2S1(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5409 |
| logD: | 1.5409 |
| logSw: | -2.4881 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.684 |
| InChI Key: | MSENZEKLDNFOBN-LBPRGKRZSA-N |