4-[1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-[1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzene-1-sulfonamide
4-[1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | IB08-0008 |
| Compound Name: | 4-[1,7-dimethyl-3-(2-methylprop-2-en-1-yl)-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzene-1-sulfonamide |
| Molecular Weight: | 428.47 |
| Molecular Formula: | C19 H20 N6 O4 S |
| Smiles: | CC(=C)CN1C(c2c(nc3N(C(C)=Cn23)c2ccc(cc2)S(N)(=O)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.28 |
| logD: | 1.28 |
| logSw: | -2.47 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 197.28 |
| InChI Key: | QRICQMBKQKXSHQ-UHFFFAOYSA-N |