N-[3-{[4-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-2-fluorobenzamide
Chemical Structure Depiction of
N-[3-{[4-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-2-fluorobenzamide
N-[3-{[4-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-2-fluorobenzamide
Compound characteristics
| Compound ID: | V026-2911 |
| Compound Name: | N-[3-{[4-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-2-fluorobenzamide |
| Molecular Weight: | 480.6 |
| Molecular Formula: | C26 H29 F N4 O2 S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(c1ccc(CN2C(C)=C(C)SC/2=N/C(c2ccccc2F)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3943 |
| logD: | 3.2181 |
| logSw: | -3.5638 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.945 |
| InChI Key: | QORUPDZIXIUQHW-UHFFFAOYSA-N |