N-[3-(1-{[(4-fluorophenyl)methyl]amino}-1-oxopropan-2-yl)-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide
Chemical Structure Depiction of
N-[3-(1-{[(4-fluorophenyl)methyl]amino}-1-oxopropan-2-yl)-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide
N-[3-(1-{[(4-fluorophenyl)methyl]amino}-1-oxopropan-2-yl)-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide
Compound characteristics
| Compound ID: | V026-3085 |
| Compound Name: | N-[3-(1-{[(4-fluorophenyl)methyl]amino}-1-oxopropan-2-yl)-1,3-thiazol-2(3H)-ylidene]-3-methoxybenzamide |
| Molecular Weight: | 413.47 |
| Molecular Formula: | C21 H20 F N3 O3 S |
| Smiles: | CC(C(NCc1ccc(cc1)F)=O)N1C=CSC/1=N/C(c1cccc(c1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1836 |
| logD: | 2.1836 |
| logSw: | -2.7258 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.605 |
| InChI Key: | XOXKFQBZWAMGJJ-CQEAMPFXSA-N |