N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | Y503-0705 |
| Compound Name: | N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 506.45 |
| Molecular Formula: | C24 H25 Cl2 N3 O3 S |
| Smiles: | Cc1c(C(Nc2c(C(N)=O)c3CCC(Cc3s2)C(C)(C)C)=O)c(c2c(cccc2[Cl])[Cl])no1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6938 |
| logD: | 2.0419 |
| logSw: | -4.9078 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.064 |
| InChI Key: | PBLJQUYVVUZEHL-GFCCVEGCSA-N |