N-[3-(4-benzylpiperazine-1-carbonyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-fluorobenzamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazine-1-carbonyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-fluorobenzamide
N-[3-(4-benzylpiperazine-1-carbonyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-fluorobenzamide
Compound characteristics
| Compound ID: | 4473-0236 |
| Compound Name: | N-[3-(4-benzylpiperazine-1-carbonyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-fluorobenzamide |
| Molecular Weight: | 533.71 |
| Molecular Formula: | C31 H36 F N3 O2 S |
| Smiles: | CC(C)(C)C1CCc2c(C(N3CCN(CC3)Cc3ccccc3)=O)c(NC(c3ccccc3F)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0473 |
| logD: | 2.4677 |
| logSw: | -5.4846 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.233 |
| InChI Key: | XEZMUFODNICXKW-JOCHJYFZSA-N |