8-(4-chlorophenyl)-1-methyl-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Chemical Structure Depiction of
8-(4-chlorophenyl)-1-methyl-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
8-(4-chlorophenyl)-1-methyl-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione
Compound characteristics
| Compound ID: | E461-0344 |
| Compound Name: | 8-(4-chlorophenyl)-1-methyl-3-(prop-2-en-1-yl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione |
| Molecular Weight: | 357.8 |
| Molecular Formula: | C17 H16 Cl N5 O2 |
| Smiles: | CN1C(N(CC=C)C(c2c1nc1N(CCn12)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2408 |
| logD: | 3.0131 |
| logSw: | -3.5131 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.399 |
| InChI Key: | JMVCAAVXAIHFEL-UHFFFAOYSA-N |