N-[3-(4-benzylpiperazine-1-carbonyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylbenzamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazine-1-carbonyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylbenzamide
N-[3-(4-benzylpiperazine-1-carbonyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylbenzamide
Compound characteristics
| Compound ID: | 4473-0226 |
| Compound Name: | N-[3-(4-benzylpiperazine-1-carbonyl)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylbenzamide |
| Molecular Weight: | 529.75 |
| Molecular Formula: | C32 H39 N3 O2 S |
| Smiles: | Cc1ccccc1C(Nc1c(C(N2CCN(CC2)Cc2ccccc2)=O)c2CCC(Cc2s1)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2833 |
| logD: | 3.1046 |
| logSw: | -5.4401 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.233 |
| InChI Key: | RCFBXVMRCYXQBS-XMMPIXPASA-N |