1-{4-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-methyl-1-oxopropan-2-yl acetate
Chemical Structure Depiction of
1-{4-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-methyl-1-oxopropan-2-yl acetate
1-{4-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-methyl-1-oxopropan-2-yl acetate
Compound characteristics
| Compound ID: | V015-1232 |
| Compound Name: | 1-{4-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-methoxyphenyl]piperazin-1-yl}-2-methyl-1-oxopropan-2-yl acetate |
| Molecular Weight: | 515.63 |
| Molecular Formula: | C26 H33 N3 O6 S |
| Salt: | not_available |
| Smiles: | CC(=O)OC(C)(C)C(N1CCN(CC1)c1cc(ccc1OC)S(N1CCc2ccccc2C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3273 |
| logD: | 3.3273 |
| logSw: | -3.9446 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 79.072 |
| InChI Key: | HZHDOXFVDXLGMX-UHFFFAOYSA-N |