4-[(3-chlorophenyl)methyl]-N-(3-methoxypropyl)-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(3-chlorophenyl)methyl]-N-(3-methoxypropyl)-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(3-chlorophenyl)methyl]-N-(3-methoxypropyl)-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V014-8487 |
| Compound Name: | 4-[(3-chlorophenyl)methyl]-N-(3-methoxypropyl)-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 428.87 |
| Molecular Formula: | C21 H21 Cl N4 O4 |
| Smiles: | COCCCNC(C1C(N(Cc2cccc(c2)[Cl])C(N(c2ccccc2)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8765 |
| logD: | 2.8764 |
| logSw: | -3.5987 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.114 |
| InChI Key: | SIGZBEJASHGDIB-UHFFFAOYSA-N |