N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-(4-methoxyphenyl)-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-(4-methoxyphenyl)-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-(4-methoxyphenyl)-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide
Compound characteristics
| Compound ID: | C548-0370 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-N-(4-methoxyphenyl)-6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-sulfonamide |
| Molecular Weight: | 484.53 |
| Molecular Formula: | C23 H24 N4 O6 S |
| Smiles: | CC1=C(C(NC(N1)=O)=O)S(N(CC(N1CCc2ccccc2C1)=O)c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4297 |
| logD: | -1.0397 |
| logSw: | -2.4571 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.925 |
| InChI Key: | OJNAIMMRPJZZQQ-UHFFFAOYSA-N |