6-[(4-fluorophenyl)methyl]-2-methyl-4-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-2H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
Chemical Structure Depiction of
6-[(4-fluorophenyl)methyl]-2-methyl-4-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-2H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
6-[(4-fluorophenyl)methyl]-2-methyl-4-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-2H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
Compound characteristics
| Compound ID: | L681-0304 |
| Compound Name: | 6-[(4-fluorophenyl)methyl]-2-methyl-4-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-2H-pyrazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione |
| Molecular Weight: | 463.47 |
| Molecular Formula: | C24 H22 F N5 O4 |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CN1C(N(Cc2ccc(cc2)F)C(c2c1cn(C)n2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2742 |
| logD: | 2.2742 |
| logSw: | -2.5144 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.721 |
| InChI Key: | ZOOXLVMOJVDNMW-UHFFFAOYSA-N |