methyl 5-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}-4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxylate
Chemical Structure Depiction of
methyl 5-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}-4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxylate
methyl 5-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}-4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxylate
Compound characteristics
| Compound ID: | C855-0007 |
| Compound Name: | methyl 5-{[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}-4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carboxylate |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C25 H25 N3 O4 |
| Smiles: | Cc1cccc(c1)c1nc(CN2C(C3CCCN3c3ccc(cc23)C(=O)OC)=O)c(C)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7725 |
| logD: | 3.7725 |
| logSw: | -4.0492 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.454 |
| InChI Key: | BPJVANKHKZLTFS-NRFANRHFSA-N |