N-[3-{[3-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-[3-{[3-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
N-[3-{[3-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | V027-2017 |
| Compound Name: | N-[3-{[3-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide |
| Molecular Weight: | 522.67 |
| Molecular Formula: | C28 H34 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(c1cccc(CN2C(C)=C(C)SC/2=N/C(c2ccc(c(c2)OC)OC)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8269 |
| logD: | 2.6507 |
| logSw: | -3.1046 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.206 |
| InChI Key: | CXRVYBOXOBYJGX-UHFFFAOYSA-N |