(2S)-N-[2-(1H-imidazol-4-yl)ethyl]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Chemical Structure Depiction of
(2S)-N-[2-(1H-imidazol-4-yl)ethyl]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
(2S)-N-[2-(1H-imidazol-4-yl)ethyl]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Compound characteristics
| Compound ID: | Y044-3976 |
| Compound Name: | (2S)-N-[2-(1H-imidazol-4-yl)ethyl]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide |
| Molecular Weight: | 312.33 |
| Molecular Formula: | C15 H16 N6 O2 |
| Smiles: | C[C@@H](C(NCCc1c[nH]cn1)=O)N1C(c2ccccc2N=N1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.9989 |
| logD: | 0.9011 |
| logSw: | -2.1744 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.786 |
| InChI Key: | LUHZVULGORVFIX-JTQLQIEISA-N |