3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(phenyl)amino]propyl 4-methoxybenzoate
Chemical Structure Depiction of
3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(phenyl)amino]propyl 4-methoxybenzoate
3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(phenyl)amino]propyl 4-methoxybenzoate
Compound characteristics
| Compound ID: | 8010-0502 |
| Compound Name: | 3-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)(phenyl)amino]propyl 4-methoxybenzoate |
| Molecular Weight: | 450.51 |
| Molecular Formula: | C24 H22 N2 O5 S |
| Smiles: | COc1ccc(cc1)C(=O)OCCCN(C1c2ccccc2S(N=1)(=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6267 |
| logD: | 4.6267 |
| logSw: | -4.354 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.403 |
| InChI Key: | JHOUZDNWISFWHG-UHFFFAOYSA-N |