dimethyl 2-[(7-methoxy-1-benzoxepine-4-carbonyl)amino]benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-[(7-methoxy-1-benzoxepine-4-carbonyl)amino]benzene-1,4-dicarboxylate
dimethyl 2-[(7-methoxy-1-benzoxepine-4-carbonyl)amino]benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | D443-0768 |
| Compound Name: | dimethyl 2-[(7-methoxy-1-benzoxepine-4-carbonyl)amino]benzene-1,4-dicarboxylate |
| Molecular Weight: | 409.39 |
| Molecular Formula: | C22 H19 N O7 |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(C1C=COc2ccc(cc2C=1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0985 |
| logD: | 3.9734 |
| logSw: | -4.3696 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.148 |
| InChI Key: | QXWGCVMYLHEDEN-UHFFFAOYSA-N |