N-(3-{2-[2-(3,4-dimethoxyphenyl)ethyl]-1,4-dioxo-1,3,4,6,7,8-hexahydro-2H-pyrido[1,2-a]pyrazin-9-yl}-4-hydroxyphenyl)-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-(3-{2-[2-(3,4-dimethoxyphenyl)ethyl]-1,4-dioxo-1,3,4,6,7,8-hexahydro-2H-pyrido[1,2-a]pyrazin-9-yl}-4-hydroxyphenyl)-4-methylbenzene-1-sulfonamide
N-(3-{2-[2-(3,4-dimethoxyphenyl)ethyl]-1,4-dioxo-1,3,4,6,7,8-hexahydro-2H-pyrido[1,2-a]pyrazin-9-yl}-4-hydroxyphenyl)-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8018-8054 |
| Compound Name: | N-(3-{2-[2-(3,4-dimethoxyphenyl)ethyl]-1,4-dioxo-1,3,4,6,7,8-hexahydro-2H-pyrido[1,2-a]pyrazin-9-yl}-4-hydroxyphenyl)-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 591.68 |
| Molecular Formula: | C31 H33 N3 O7 S |
| Smiles: | Cc1ccc(cc1)S(Nc1ccc(c(c1)C1CCCN2C=1C(N(CCc1ccc(c(c1)OC)OC)CC2=O)=O)O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3405 |
| logD: | 4.054 |
| logSw: | -3.8707 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.349 |
| InChI Key: | YCJKFUYSSHSLAN-UHFFFAOYSA-N |