N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(propan-2-yl)-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-(propan-2-yl)-1,2-oxazole-3-carboxamide
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-2949 |
| Compound Name: | N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(propan-2-yl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C20 H25 N3 O2 S |
| Smiles: | CC(C)c1cc(C(Nc2c(C#N)c3CCC(Cc3s2)C(C)(C)C)=O)no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.462 |
| logD: | 3.7916 |
| logSw: | -5.395 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.908 |
| InChI Key: | VAPAOKBCGGZGCD-GFCCVEGCSA-N |