3-(3-chlorophenyl)-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(3-chlorophenyl)-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
3-(3-chlorophenyl)-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V011-7092 |
| Compound Name: | 3-(3-chlorophenyl)-1-(prop-2-en-1-yl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 344.8 |
| Molecular Formula: | C17 H17 Cl N4 O2 |
| Salt: | not_available |
| Smiles: | CCCn1cnc2c1C(N(CC=C)C(N2c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7208 |
| logD: | 2.7208 |
| logSw: | -3.2014 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.774 |
| InChI Key: | NFMICDOXJIAZIK-UHFFFAOYSA-N |