(2S)-N-{[3-(4-methyl-1,3-thiazol-2-yl)phenyl]methyl}-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Chemical Structure Depiction of
(2S)-N-{[3-(4-methyl-1,3-thiazol-2-yl)phenyl]methyl}-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
(2S)-N-{[3-(4-methyl-1,3-thiazol-2-yl)phenyl]methyl}-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Compound characteristics
| Compound ID: | Y043-4164 |
| Compound Name: | (2S)-N-{[3-(4-methyl-1,3-thiazol-2-yl)phenyl]methyl}-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide |
| Molecular Weight: | 405.48 |
| Molecular Formula: | C21 H19 N5 O2 S |
| Smiles: | Cc1csc(c2cccc(CNC([C@H](C)N3C(c4ccccc4N=N3)=O)=O)c2)n1 |
| Stereo: | ABSOLUTE |
| logP: | 3.5222 |
| logD: | 3.5222 |
| logSw: | -3.8249 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.691 |
| InChI Key: | ZJQGPFOYFCACEM-AWEZNQCLSA-N |