methyl 4-{5-[(2-imino-3-methyl-5-oxoimidazolidin-4-ylidene)methyl]furan-2-yl}benzoate
Chemical Structure Depiction of
methyl 4-{5-[(2-imino-3-methyl-5-oxoimidazolidin-4-ylidene)methyl]furan-2-yl}benzoate
methyl 4-{5-[(2-imino-3-methyl-5-oxoimidazolidin-4-ylidene)methyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 4489-2938 |
| Compound Name: | methyl 4-{5-[(2-imino-3-methyl-5-oxoimidazolidin-4-ylidene)methyl]furan-2-yl}benzoate |
| Molecular Weight: | 325.32 |
| Molecular Formula: | C17 H15 N3 O4 |
| Smiles: | CN1C(=C\c2ccc(c3ccc(cc3)C(=O)OC)o2)\C(NC1=N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5556 |
| logD: | 2.5528 |
| logSw: | -2.8837 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.87 |
| InChI Key: | AMGVFYGGFPCFRQ-UHFFFAOYSA-N |