7,7-dimethyl-2,5-dioxo-1-phenyl-N-(4H-1,2,4-triazol-4-yl)-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Chemical Structure Depiction of
7,7-dimethyl-2,5-dioxo-1-phenyl-N-(4H-1,2,4-triazol-4-yl)-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
7,7-dimethyl-2,5-dioxo-1-phenyl-N-(4H-1,2,4-triazol-4-yl)-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8016-0765 |
| Compound Name: | 7,7-dimethyl-2,5-dioxo-1-phenyl-N-(4H-1,2,4-triazol-4-yl)-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide |
| Molecular Weight: | 377.4 |
| Molecular Formula: | C20 H19 N5 O3 |
| Smiles: | CC1(C)CC2=C(C=C(C(Nn3cnnc3)=O)C(N2c2ccccc2)=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.512 |
| logD: | 0.512 |
| logSw: | -1.799 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.533 |
| InChI Key: | WBGKCXWUMUZCCE-UHFFFAOYSA-N |