1-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]-3-[(naphthalen-1-yl)oxy]propan-2-yl 2-bromobenzoate
Chemical Structure Depiction of
1-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]-3-[(naphthalen-1-yl)oxy]propan-2-yl 2-bromobenzoate
1-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]-3-[(naphthalen-1-yl)oxy]propan-2-yl 2-bromobenzoate
Compound characteristics
| Compound ID: | 8010-0488 |
| Compound Name: | 1-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]-3-[(naphthalen-1-yl)oxy]propan-2-yl 2-bromobenzoate |
| Molecular Weight: | 579.47 |
| Molecular Formula: | C28 H23 Br N2 O5 S |
| Smiles: | CN(CC(COc1cccc2ccccc12)OC(c1ccccc1[Br])=O)C1c2ccccc2S(N=1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8662 |
| logD: | 5.8662 |
| logSw: | -6.6765 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.874 |
| InChI Key: | CSGZTTORPBTMGL-FQEVSTJZSA-N |