4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-N-propyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-N-propyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-N-propyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V013-9944 |
| Compound Name: | 4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-N-propyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 412.42 |
| Molecular Formula: | C21 H21 F N4 O4 |
| Smiles: | CCCNC(C1C(N(Cc2ccc(cc2)F)C(N(c2ccc(cc2)OC)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8875 |
| logD: | 2.8875 |
| logSw: | -3.3441 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.315 |
| InChI Key: | KGVMLNALCPPVCQ-UHFFFAOYSA-N |