N-{6-tert-butyl-3-[(2,4-dimethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}pyridine-3-carboxamide
Chemical Structure Depiction of
N-{6-tert-butyl-3-[(2,4-dimethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}pyridine-3-carboxamide
N-{6-tert-butyl-3-[(2,4-dimethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | 4473-0931 |
| Compound Name: | N-{6-tert-butyl-3-[(2,4-dimethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}pyridine-3-carboxamide |
| Molecular Weight: | 461.63 |
| Molecular Formula: | C27 H31 N3 O2 S |
| Smiles: | Cc1ccc(c(C)c1)NC(c1c2CCC(Cc2sc1NC(c1cccnc1)=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0919 |
| logD: | 4.6646 |
| logSw: | -5.138 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.956 |
| InChI Key: | LEURXRQOFFYEAK-LJQANCHMSA-N |