N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-0327 |
| Compound Name: | N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C23 H22 F N3 O2 S |
| Smiles: | CC(C)(C)C1CCc2c(C#N)c(NC(c3cc(c4ccc(cc4)F)on3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0744 |
| logD: | 4.7834 |
| logSw: | -5.5146 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.636 |
| InChI Key: | SSARRILCVBOTDN-CQSZACIVSA-N |