N-{3-[(1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Chemical Structure Depiction of
N-{3-[(1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
N-{3-[(1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Compound characteristics
| Compound ID: | Y043-0095 |
| Compound Name: | N-{3-[(1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide |
| Molecular Weight: | 383.42 |
| Molecular Formula: | C19 H17 N3 O4 S |
| Smiles: | C(CNC(C1COc2ccccc2O1)=O)C(Nc1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8054 |
| logD: | 2.8053 |
| logSw: | -3.3488 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.841 |
| InChI Key: | JFVQFEVGHVWLBL-HNNXBMFYSA-N |