N-{4-[1-{2-[(3-methoxypropyl)amino]-2-oxoethyl}-3,4-dihydroisoquinoline-2(1H)-sulfonyl]phenyl}propanamide
Chemical Structure Depiction of
N-{4-[1-{2-[(3-methoxypropyl)amino]-2-oxoethyl}-3,4-dihydroisoquinoline-2(1H)-sulfonyl]phenyl}propanamide
N-{4-[1-{2-[(3-methoxypropyl)amino]-2-oxoethyl}-3,4-dihydroisoquinoline-2(1H)-sulfonyl]phenyl}propanamide
Compound characteristics
| Compound ID: | F714-0940 |
| Compound Name: | N-{4-[1-{2-[(3-methoxypropyl)amino]-2-oxoethyl}-3,4-dihydroisoquinoline-2(1H)-sulfonyl]phenyl}propanamide |
| Molecular Weight: | 473.59 |
| Molecular Formula: | C24 H31 N3 O5 S |
| Smiles: | CCC(Nc1ccc(cc1)S(N1CCc2ccccc2C1CC(NCCCOC)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3002 |
| logD: | 2.2997 |
| logSw: | -2.8914 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.729 |
| InChI Key: | JJJPSCIJHJHWKU-QFIPXVFZSA-N |