1-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]-3-[(naphthalen-1-yl)oxy]propan-2-yl 2,4-dichlorobenzoate
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 2,4-dichlorobenzoate
1-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]-3-[(naphthalen-1-yl)oxy]propan-2-yl 2,4-dichlorobenzoate
Compound characteristics
| Compound ID: | 8009-5691 |
| Compound Name: | 1-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(methyl)amino]-3-[(naphthalen-1-yl)oxy]propan-2-yl 2,4-dichlorobenzoate |
| Molecular Weight: | 569.46 |
| Molecular Formula: | C28 H22 Cl2 N2 O5 S |
| Smiles: | CN(CC(COc1cccc2ccccc12)OC(c1ccc(cc1[Cl])[Cl])=O)C1c2ccccc2S(N=1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8098 |
| logD: | 6.8098 |
| logSw: | -6.537 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.874 |
| InChI Key: | FZFUMTGYKYRLRX-FQEVSTJZSA-N |