N-[3-{[2-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4-methyl-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-[3-{[2-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4-methyl-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
N-[3-{[2-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4-methyl-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | V014-0331 |
| Compound Name: | N-[3-{[2-(4-ethylpiperazine-1-carbonyl)phenyl]methyl}-4-methyl-1,3-thiazol-2(3H)-ylidene]-3,4-dimethoxybenzamide |
| Molecular Weight: | 508.64 |
| Molecular Formula: | C27 H32 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)C(c1ccccc1CN1C(C)=CSC/1=N/C(c1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.875 |
| logD: | 2.6988 |
| logSw: | -3.2413 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.79 |
| InChI Key: | PUCQYPJEDBYFMC-UHFFFAOYSA-N |