3-{[3-(2,3-dimethoxypropoxy)propyl]amino}-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-{[3-(2,3-dimethoxypropoxy)propyl]amino}-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-{[3-(2,3-dimethoxypropoxy)propyl]amino}-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
| Compound ID: | 8002-7898 |
| Compound Name: | 3-{[3-(2,3-dimethoxypropoxy)propyl]amino}-6-nitro-1H-1lambda~6~,2-benzothiazole-1,1-dione |
| Molecular Weight: | 387.41 |
| Molecular Formula: | C15 H21 N3 O7 S |
| Smiles: | COCC(COCCCNC1c2ccc(cc2S(N=1)(=O)=O)[N+]([O-])=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4626 |
| logD: | 0.4626 |
| logSw: | -2.4541 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.531 |
| InChI Key: | NZJILIKUHKBSAA-LBPRGKRZSA-N |