6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-(prop-2-en-1-yl)quinolin-4(1H)-one
Chemical Structure Depiction of
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-(prop-2-en-1-yl)quinolin-4(1H)-one
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-(prop-2-en-1-yl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | C519-3065 |
| Compound Name: | 6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-(prop-2-en-1-yl)quinolin-4(1H)-one |
| Molecular Weight: | 598.72 |
| Molecular Formula: | C33 H34 N4 O5 S |
| Smiles: | COc1ccccc1N1CCN(CC1)C(C1=CN(CC=C)c2ccc(cc2C1=O)S(N1CCc2ccccc2C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.206 |
| logD: | 4.206 |
| logSw: | -4.2485 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.423 |
| InChI Key: | IXVXGRXYMVHEFU-UHFFFAOYSA-N |