methyl 4-{[2-(naphthalen-1-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[2-(naphthalen-1-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzoate
methyl 4-{[2-(naphthalen-1-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | 3448-4849 |
| Compound Name: | methyl 4-{[2-(naphthalen-1-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzoate |
| Molecular Weight: | 450.45 |
| Molecular Formula: | C27 H18 N2 O5 |
| Smiles: | COC(c1ccc(cc1)NC(c1ccc2C(N(C(c2c1)=O)c1cccc2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1603 |
| logD: | 5.1246 |
| logSw: | -5.9656 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.572 |
| InChI Key: | LCJCJIJQQHMPJI-UHFFFAOYSA-N |