2-(pyrrolidine-1-carbonyl)-N-{[4-(pyrrolidin-1-yl)phenyl]methyl}-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
Chemical Structure Depiction of
2-(pyrrolidine-1-carbonyl)-N-{[4-(pyrrolidin-1-yl)phenyl]methyl}-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
2-(pyrrolidine-1-carbonyl)-N-{[4-(pyrrolidin-1-yl)phenyl]methyl}-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide
Compound characteristics
| Compound ID: | T408-2038 |
| Compound Name: | 2-(pyrrolidine-1-carbonyl)-N-{[4-(pyrrolidin-1-yl)phenyl]methyl}-4,5,6,7-tetrahydro-1-benzothiophene-5-carboxamide |
| Molecular Weight: | 437.6 |
| Molecular Formula: | C25 H31 N3 O2 S |
| Smiles: | C1CCN(C1)C(c1cc2CC(CCc2s1)C(NCc1ccc(cc1)N1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1709 |
| logD: | 4.1703 |
| logSw: | -4.1673 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.423 |
| InChI Key: | OUDVSTYCLXEMQX-LJQANCHMSA-N |