2-amino-8'-methoxy-4',4',6',7,7-pentamethyl-2',5-dioxo-5,6,7,8-tetrahydro-2'H,4'H-spiro[[1]benzopyran-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile
Chemical Structure Depiction of
2-amino-8'-methoxy-4',4',6',7,7-pentamethyl-2',5-dioxo-5,6,7,8-tetrahydro-2'H,4'H-spiro[[1]benzopyran-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile
2-amino-8'-methoxy-4',4',6',7,7-pentamethyl-2',5-dioxo-5,6,7,8-tetrahydro-2'H,4'H-spiro[[1]benzopyran-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile
Compound characteristics
| Compound ID: | Y020-0986 |
| Compound Name: | 2-amino-8'-methoxy-4',4',6',7,7-pentamethyl-2',5-dioxo-5,6,7,8-tetrahydro-2'H,4'H-spiro[[1]benzopyran-4,1'-pyrrolo[3,2,1-ij]quinoline]-3-carbonitrile |
| Molecular Weight: | 445.52 |
| Molecular Formula: | C26 H27 N3 O4 |
| Smiles: | CC1=CC(C)(C)N2C(C3(C(C#N)=C(N)OC4CC(C)(C)CC(C3=4)=O)c3cc(cc1c23)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4948 |
| logD: | 3.4948 |
| logSw: | -4.0947 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.601 |
| InChI Key: | QYCFWWOUTPVTOV-AREMUKBSSA-N |