ethyl 4-{1-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)amino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{1-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)amino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate
ethyl 4-{1-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)amino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C429-0363 |
| Compound Name: | ethyl 4-{1-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)amino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C26 H27 N3 O5 |
| Smiles: | CCOC(N1CCC(CC1)N1C(c2ccccc2C1=O)Nc1ccc2C(C)=CC(=O)Oc2c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7722 |
| logD: | 3.7722 |
| logSw: | -3.944 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.411 |
| InChI Key: | NVDWZMNKWRPAMJ-DEOSSOPVSA-N |