4-{(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)[(4-methoxyphenyl)methyl]amino}phenyl 3-(4-methoxyphenyl)prop-2-enoate
Chemical Structure Depiction of
4-{(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)[(4-methoxyphenyl)methyl]amino}phenyl 3-(4-methoxyphenyl)prop-2-enoate
4-{(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)[(4-methoxyphenyl)methyl]amino}phenyl 3-(4-methoxyphenyl)prop-2-enoate
Compound characteristics
| Compound ID: | 6313-0014 |
| Compound Name: | 4-{(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)[(4-methoxyphenyl)methyl]amino}phenyl 3-(4-methoxyphenyl)prop-2-enoate |
| Molecular Weight: | 554.62 |
| Molecular Formula: | C31 H26 N2 O6 S |
| Smiles: | COc1ccc(CN(C2c3ccccc3S(N=2)(=O)=O)c2ccc(cc2)OC(/C=C/c2ccc(cc2)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.87 |
| logD: | 5.87 |
| logSw: | -5.5925 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.703 |
| InChI Key: | VKPJBYDVOFAREC-UHFFFAOYSA-N |