methyl 2,7,7-trimethyl-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2,7,7-trimethyl-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 2,7,7-trimethyl-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8016-8962 |
| Compound Name: | methyl 2,7,7-trimethyl-4-{4-[(morpholin-4-yl)methyl]thiophen-2-yl}-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 430.57 |
| Molecular Formula: | C23 H30 N2 O4 S |
| Smiles: | CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c1cc(CN2CCOCC2)cs1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6825 |
| logD: | 2.6825 |
| logSw: | -2.9238 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.755 |
| InChI Key: | RMHPSRRVUFUXKI-NRFANRHFSA-N |