N-benzyl-4-ethyl-2-[4-(methanesulfonyl)phenyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-4-ethyl-2-[4-(methanesulfonyl)phenyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-benzyl-4-ethyl-2-[4-(methanesulfonyl)phenyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V028-6387 |
| Compound Name: | N-benzyl-4-ethyl-2-[4-(methanesulfonyl)phenyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 428.47 |
| Molecular Formula: | C20 H20 N4 O5 S |
| Smiles: | CCN1C(C(C(NCc2ccccc2)=O)=NN(C1=O)c1ccc(cc1)S(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1942 |
| logD: | 1.1687 |
| logSw: | -2.3644 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.403 |
| InChI Key: | ZBZXSMZVICMAPP-UHFFFAOYSA-N |