1-cyclopropyl-3-(3-methoxyphenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-cyclopropyl-3-(3-methoxyphenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
1-cyclopropyl-3-(3-methoxyphenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V023-5031 |
| Compound Name: | 1-cyclopropyl-3-(3-methoxyphenyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C18 H18 N4 O3 |
| Smiles: | COc1cccc(c1)N1C(N(C2CC2)C(c2c1ncn2CC=C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0039 |
| logD: | 2.0039 |
| logSw: | -2.2927 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.621 |
| InChI Key: | YTXZJCBTDVVCDQ-UHFFFAOYSA-N |