4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]-N-(pyridin-4-yl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]-N-(pyridin-4-yl)cyclohexane-1-carboxamide
4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]-N-(pyridin-4-yl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | Y040-2986 |
| Compound Name: | 4-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)methyl]-N-(pyridin-4-yl)cyclohexane-1-carboxamide |
| Molecular Weight: | 363.42 |
| Molecular Formula: | C20 H21 N5 O2 |
| Smiles: | C1C[C@@H](CC[C@H]1CN1C(c2ccccc2N=N1)=O)C(Nc1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7856 |
| logD: | 2.7101 |
| logSw: | -3.5311 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.644 |
| InChI Key: | SBLXJJYYIKNXNF-UHFFFAOYSA-N |