1-[(6-nitro-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl (2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetate
Chemical Structure Depiction of
1-[(6-nitro-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl (2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetate
1-[(6-nitro-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl (2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetate
Compound characteristics
| Compound ID: | 5471-0141 |
| Compound Name: | 1-[(6-nitro-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl (2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetate |
| Molecular Weight: | 468.44 |
| Molecular Formula: | C21 H16 N4 O7 S |
| Smiles: | CCC(C(Nc1nc2ccc(cc2s1)[N+]([O-])=O)=O)OC(CN1C(C(c2ccccc12)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0545 |
| logD: | 3.0543 |
| logSw: | -3.7555 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 115.066 |
| InChI Key: | YAOXOOONJKJJDA-HNNXBMFYSA-N |