4-[(2-chlorophenyl)methyl]-2-(3-methylphenyl)-6-(pyrrolidine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione
Chemical Structure Depiction of
4-[(2-chlorophenyl)methyl]-2-(3-methylphenyl)-6-(pyrrolidine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione
4-[(2-chlorophenyl)methyl]-2-(3-methylphenyl)-6-(pyrrolidine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione
Compound characteristics
| Compound ID: | V014-9680 |
| Compound Name: | 4-[(2-chlorophenyl)methyl]-2-(3-methylphenyl)-6-(pyrrolidine-1-carbonyl)-1,2,4-triazine-3,5(2H,4H)-dione |
| Molecular Weight: | 424.89 |
| Molecular Formula: | C22 H21 Cl N4 O3 |
| Smiles: | Cc1cccc(c1)N1C(N(Cc2ccccc2[Cl])C(C(C(N2CCCC2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.937 |
| logD: | 3.937 |
| logSw: | -4.0706 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.259 |
| InChI Key: | CWHUVJYEVWDLPG-UHFFFAOYSA-N |