4-[(3-fluorophenyl)methyl]-2-phenyl-6-(pyrrolidine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione
Chemical Structure Depiction of
4-[(3-fluorophenyl)methyl]-2-phenyl-6-(pyrrolidine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione
4-[(3-fluorophenyl)methyl]-2-phenyl-6-(pyrrolidine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | V022-1111 |
| Compound Name: | 4-[(3-fluorophenyl)methyl]-2-phenyl-6-(pyrrolidine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione |
| Molecular Weight: | 394.4 |
| Molecular Formula: | C21 H19 F N4 O3 |
| Smiles: | C1CCN(C1)C(C1C(N(Cc2cccc(c2)F)C(N(c2ccccc2)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9504 |
| logD: | 2.9504 |
| logSw: | -3.2766 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.259 |
| InChI Key: | ACNMSBCCEIBCMR-UHFFFAOYSA-N |