N-(4-{[2-(2-methoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}phenyl)-3-(4-methylbenzene-1-sulfonyl)propanamide
Chemical Structure Depiction of
N-(4-{[2-(2-methoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}phenyl)-3-(4-methylbenzene-1-sulfonyl)propanamide
N-(4-{[2-(2-methoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}phenyl)-3-(4-methylbenzene-1-sulfonyl)propanamide
Compound characteristics
| Compound ID: | K906-0043 |
| Compound Name: | N-(4-{[2-(2-methoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]oxy}phenyl)-3-(4-methylbenzene-1-sulfonyl)propanamide |
| Molecular Weight: | 570.62 |
| Molecular Formula: | C31 H26 N2 O7 S |
| Smiles: | Cc1ccc(cc1)S(CCC(Nc1ccc(cc1)Oc1ccc2C(N(C(c2c1)=O)c1ccccc1OC)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8838 |
| logD: | 4.8838 |
| logSw: | -4.5801 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.871 |
| InChI Key: | TZBIAAGFIPSIEX-UHFFFAOYSA-N |