1-(cyclopropylmethyl)-3-(4-fluorophenyl)-7-[(2-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-(cyclopropylmethyl)-3-(4-fluorophenyl)-7-[(2-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
1-(cyclopropylmethyl)-3-(4-fluorophenyl)-7-[(2-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V016-7497 |
| Compound Name: | 1-(cyclopropylmethyl)-3-(4-fluorophenyl)-7-[(2-methoxyphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 420.44 |
| Molecular Formula: | C23 H21 F N4 O3 |
| Salt: | not_available |
| Smiles: | COc1ccccc1Cn1cnc2c1C(N(CC1CC1)C(N2c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3496 |
| logD: | 3.3496 |
| logSw: | -3.4754 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.428 |
| InChI Key: | XTCBXNJUWUNWKU-UHFFFAOYSA-N |