N-[6-tert-butyl-3-(4-methylpiperazine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-chlorobenzamide
Chemical Structure Depiction of
N-[6-tert-butyl-3-(4-methylpiperazine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-chlorobenzamide
N-[6-tert-butyl-3-(4-methylpiperazine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-chlorobenzamide
Compound characteristics
| Compound ID: | 4488-1864 |
| Compound Name: | N-[6-tert-butyl-3-(4-methylpiperazine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-chlorobenzamide |
| Molecular Weight: | 474.06 |
| Molecular Formula: | C25 H32 Cl N3 O2 S |
| Smiles: | CC(C)(C)C1CCc2c(C(N3CCN(C)CC3)=O)c(NC(c3cccc(c3)[Cl])=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2289 |
| logD: | 1.6903 |
| logSw: | -5.8356 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.169 |
| InChI Key: | VHOKDFBNXWEYMN-QGZVFWFLSA-N |