N-(3,4,5-trimethoxyphenyl)-3-(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purine-8-sulfonyl)propanamide
Chemical Structure Depiction of
N-(3,4,5-trimethoxyphenyl)-3-(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purine-8-sulfonyl)propanamide
N-(3,4,5-trimethoxyphenyl)-3-(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purine-8-sulfonyl)propanamide
Compound characteristics
| Compound ID: | M916-0015 |
| Compound Name: | N-(3,4,5-trimethoxyphenyl)-3-(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purine-8-sulfonyl)propanamide |
| Molecular Weight: | 495.51 |
| Molecular Formula: | C20 H25 N5 O8 S |
| Smiles: | CN1C(c2c(N(C)C1=O)n(C)c(n2)S(CCC(Nc1cc(c(c(c1)OC)OC)OC)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2413 |
| logD: | 0.2409 |
| logSw: | -2.2463 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 119.575 |
| InChI Key: | FSUWIZDGTRUUMO-UHFFFAOYSA-N |