3-(4-methylphenyl)-1,7-di(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-methylphenyl)-1,7-di(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
3-(4-methylphenyl)-1,7-di(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V013-0784 |
| Compound Name: | 3-(4-methylphenyl)-1,7-di(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 322.36 |
| Molecular Formula: | C18 H18 N4 O2 |
| Smiles: | Cc1ccc(cc1)N1C(N(CC=C)C(c2c1ncn2CC=C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2808 |
| logD: | 2.2808 |
| logSw: | -2.373 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.774 |
| InChI Key: | WNBVVRCGZTWPQO-UHFFFAOYSA-N |