trimethyl 3-(6-methyl-2-oxo-2H-1,4-benzoxazin-3(4H)-ylidene)prop-1-ene-1,2,3-tricarboxylate
Chemical Structure Depiction of
trimethyl 3-(6-methyl-2-oxo-2H-1,4-benzoxazin-3(4H)-ylidene)prop-1-ene-1,2,3-tricarboxylate
trimethyl 3-(6-methyl-2-oxo-2H-1,4-benzoxazin-3(4H)-ylidene)prop-1-ene-1,2,3-tricarboxylate
Compound characteristics
| Compound ID: | Y020-5942 |
| Compound Name: | trimethyl 3-(6-methyl-2-oxo-2H-1,4-benzoxazin-3(4H)-ylidene)prop-1-ene-1,2,3-tricarboxylate |
| Molecular Weight: | 375.33 |
| Molecular Formula: | C18 H17 N O8 |
| Smiles: | Cc1ccc2c(c1)NC(=C(\C(=C\C(=O)OC)C(=O)OC)C(=O)OC)\C(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 1.7132 |
| logD: | 1.3994 |
| logSw: | -2.158 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.766 |
| InChI Key: | HXBCGSLCKJPPGE-UHFFFAOYSA-N |