2-({1,3-dioxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-5-carbonyl}amino)-4,5-dimethoxybenzoic acid
Chemical Structure Depiction of
2-({1,3-dioxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-5-carbonyl}amino)-4,5-dimethoxybenzoic acid
2-({1,3-dioxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-5-carbonyl}amino)-4,5-dimethoxybenzoic acid
Compound characteristics
| Compound ID: | 4334-0985 |
| Compound Name: | 2-({1,3-dioxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-5-carbonyl}amino)-4,5-dimethoxybenzoic acid |
| Molecular Weight: | 454.44 |
| Molecular Formula: | C23 H22 N2 O8 |
| Smiles: | COc1cc(C(O)=O)c(cc1OC)NC(c1ccc2C(N(CC3CCCO3)C(c2c1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8109 |
| logD: | -1.6694 |
| logSw: | -2.4433 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.208 |
| InChI Key: | BPZOEGYBUGVRCE-CYBMUJFWSA-N |