2-(3-{[1-(2H-1,3-benzodioxol-5-yl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-1H-indol-1-yl)-N-phenylacetamide
Chemical Structure Depiction of
2-(3-{[1-(2H-1,3-benzodioxol-5-yl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-1H-indol-1-yl)-N-phenylacetamide
2-(3-{[1-(2H-1,3-benzodioxol-5-yl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-1H-indol-1-yl)-N-phenylacetamide
Compound characteristics
| Compound ID: | 4724-5433 |
| Compound Name: | 2-(3-{[1-(2H-1,3-benzodioxol-5-yl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-1H-indol-1-yl)-N-phenylacetamide |
| Molecular Weight: | 508.49 |
| Molecular Formula: | C28 H20 N4 O6 |
| Smiles: | C(C(Nc1ccccc1)=O)n1cc(/C=C2/C(NC(N(C2=O)c2ccc3c(c2)OCO3)=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.2944 |
| logD: | 2.9226 |
| logSw: | -3.4661 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.388 |
| InChI Key: | SILCIYAAUKQBQS-UHFFFAOYSA-N |