methyl 4,5-dimethoxy-2-{[3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4,5-dimethoxy-2-{[3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}benzoate
methyl 4,5-dimethoxy-2-{[3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | D429-0242 |
| Compound Name: | methyl 4,5-dimethoxy-2-{[3-(4-methylphenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-6-carbonyl]amino}benzoate |
| Molecular Weight: | 475.5 |
| Molecular Formula: | C27 H25 N O7 |
| Smiles: | Cc1ccc(cc1)C1Cc2cc(ccc2C(=O)O1)C(Nc1cc(c(cc1C(=O)OC)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5931 |
| logD: | 2.5192 |
| logSw: | -4.4097 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.619 |
| InChI Key: | SVHFEPCQMMMKKO-QFIPXVFZSA-N |