6-[(aziridin-1-yl)methyl]-5-(4-fluorobenzoyl)-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-[(aziridin-1-yl)methyl]-5-(4-fluorobenzoyl)-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
6-[(aziridin-1-yl)methyl]-5-(4-fluorobenzoyl)-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | IB05-0176 |
| Compound Name: | 6-[(aziridin-1-yl)methyl]-5-(4-fluorobenzoyl)-1,3-dimethylpyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 317.32 |
| Molecular Formula: | C16 H16 F N3 O3 |
| Smiles: | CN1C(CN2CC2)=C(C(c2ccc(cc2)F)=O)C(N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.41 |
| logD: | 1.41 |
| logSw: | -2.02 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 97.43 |
| InChI Key: | QVTANZLIJUZGHM-UHFFFAOYSA-N |