N-[4,5-dimethyl-3-(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide
Chemical Structure Depiction of
N-[4,5-dimethyl-3-(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide
N-[4,5-dimethyl-3-(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide
Compound characteristics
| Compound ID: | V028-9855 |
| Compound Name: | N-[4,5-dimethyl-3-(2-oxo-2-{[(pyridin-2-yl)methyl]amino}ethyl)-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C21 H22 N4 O3 S |
| Smiles: | CC1=C(C)SC(=N/C(c2cccc(c2)OC)=O)\N1CC(NCc1ccccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3335 |
| logD: | 2.3325 |
| logSw: | -2.79 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.318 |
| InChI Key: | IOEGSLKFOUJBMR-FLFQWRMESA-N |