N-{4-[1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-sulfonyl]phenyl}propanamide
Chemical Structure Depiction of
N-{4-[1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-sulfonyl]phenyl}propanamide
N-{4-[1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-sulfonyl]phenyl}propanamide
Compound characteristics
| Compound ID: | F714-0904 |
| Compound Name: | N-{4-[1-(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)-3,4-dihydroisoquinoline-2(1H)-sulfonyl]phenyl}propanamide |
| Molecular Weight: | 481.57 |
| Molecular Formula: | C25 H27 N3 O5 S |
| Smiles: | CCC(Nc1ccc(cc1)S(N1CCc2ccccc2C1CC(NCc1ccco1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5174 |
| logD: | 3.5168 |
| logSw: | -3.6971 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.023 |
| InChI Key: | RSUZUZVVZRQDCK-QHCPKHFHSA-N |