3-(4-chlorophenyl)-1-(2-methoxyethyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-1-(2-methoxyethyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
3-(4-chlorophenyl)-1-(2-methoxyethyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V012-5932 |
| Compound Name: | 3-(4-chlorophenyl)-1-(2-methoxyethyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 360.8 |
| Molecular Formula: | C17 H17 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | COCCN1C(c2c(ncn2CC=C)N(C1=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.8441 |
| logD: | 1.8441 |
| logSw: | -2.4503 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.117 |
| InChI Key: | IAGCBXMOTLWAIJ-UHFFFAOYSA-N |