3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[(4-bromophenyl)methyl]pyrido[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[(4-bromophenyl)methyl]pyrido[3,2-d]pyrimidine-2,4(1H,3H)-dione
3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[(4-bromophenyl)methyl]pyrido[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | F521-0258 |
| Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[(4-bromophenyl)methyl]pyrido[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 466.29 |
| Molecular Formula: | C22 H16 Br N3 O4 |
| Smiles: | C(c1ccc2c(c1)OCO2)N1C(c2c(cccn2)N(Cc2ccc(cc2)[Br])C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3009 |
| logD: | 4.3009 |
| logSw: | -4.4818 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.291 |
| InChI Key: | HKRLUICQYJOWSX-UHFFFAOYSA-N |