methyl 9,9-dimethyl-12-(3-methylthiophen-2-yl)-11-oxo-7,8,9,10,11,12-hexahydrobenzo[b][4,7]phenanthroline-10-carboxylate
Chemical Structure Depiction of
methyl 9,9-dimethyl-12-(3-methylthiophen-2-yl)-11-oxo-7,8,9,10,11,12-hexahydrobenzo[b][4,7]phenanthroline-10-carboxylate
methyl 9,9-dimethyl-12-(3-methylthiophen-2-yl)-11-oxo-7,8,9,10,11,12-hexahydrobenzo[b][4,7]phenanthroline-10-carboxylate
Compound characteristics
| Compound ID: | 8018-9593 |
| Compound Name: | methyl 9,9-dimethyl-12-(3-methylthiophen-2-yl)-11-oxo-7,8,9,10,11,12-hexahydrobenzo[b][4,7]phenanthroline-10-carboxylate |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C25 H24 N2 O3 S |
| Smiles: | Cc1ccsc1C1C2=C(CC(C)(C)C(C2=O)C(=O)OC)Nc2ccc3c(cccn3)c12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8725 |
| logD: | 4.8505 |
| logSw: | -4.751 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.123 |
| InChI Key: | MVOLPQKOUHRUSD-UHFFFAOYSA-N |