N-(2-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(2-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-2366 |
| Compound Name: | N-(2-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 485.58 |
| Molecular Formula: | C29 H31 N3 O4 |
| Smiles: | COc1cccc(c1)N1C=C(C(NCCN(Cc2ccco2)C2CCCC2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.5836 |
| logD: | 2.891 |
| logSw: | -3.9218 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.494 |
| InChI Key: | USGUKHQPDRQENT-UHFFFAOYSA-N |