1-(cyclopropylmethyl)-3-(4-fluorophenyl)-7-[2-(4-methoxyphenyl)-2-oxoethyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-(cyclopropylmethyl)-3-(4-fluorophenyl)-7-[2-(4-methoxyphenyl)-2-oxoethyl]-3,7-dihydro-1H-purine-2,6-dione
1-(cyclopropylmethyl)-3-(4-fluorophenyl)-7-[2-(4-methoxyphenyl)-2-oxoethyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V016-6933 |
| Compound Name: | 1-(cyclopropylmethyl)-3-(4-fluorophenyl)-7-[2-(4-methoxyphenyl)-2-oxoethyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 448.45 |
| Molecular Formula: | C24 H21 F N4 O4 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)C(Cn1cnc2c1C(N(CC1CC1)C(N2c1ccc(cc1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7151 |
| logD: | 2.7151 |
| logSw: | -2.9705 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.588 |
| InChI Key: | LGJZENDWEBTMAE-UHFFFAOYSA-N |