3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-N,N-diethyl-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-6-sulfonamide
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-N,N-diethyl-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-6-sulfonamide
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-N,N-diethyl-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-6-sulfonamide
Compound characteristics
| Compound ID: | C519-2229 |
| Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-N,N-diethyl-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-6-sulfonamide |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C26 H29 N3 O4 S |
| Smiles: | CCN(CC)S(c1ccc2c(c1)C(C(=CN2CC=C)C(N1CCc2ccccc2C1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2273 |
| logD: | 3.2273 |
| logSw: | -3.7148 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.219 |
| InChI Key: | DDBGXRYSSGFXQD-UHFFFAOYSA-N |