2-(3-chlorophenyl)-4-[(3-fluorophenyl)methyl]-N-(3-methoxypropyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3-chlorophenyl)-4-[(3-fluorophenyl)methyl]-N-(3-methoxypropyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3-chlorophenyl)-4-[(3-fluorophenyl)methyl]-N-(3-methoxypropyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V007-6357 |
| Compound Name: | 2-(3-chlorophenyl)-4-[(3-fluorophenyl)methyl]-N-(3-methoxypropyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 446.86 |
| Molecular Formula: | C21 H20 Cl F N4 O4 |
| Salt: | not_available |
| Smiles: | COCCCNC(C1C(N(Cc2cccc(c2)F)C(N(c2cccc(c2)[Cl])N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1091 |
| logD: | 3.109 |
| logSw: | -3.6043 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.114 |
| InChI Key: | ISFCKLZFVCTWEL-UHFFFAOYSA-N |