N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3-fluoro-4-methylphenyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3-fluoro-4-methylphenyl)-1,2-oxazole-3-carboxamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3-fluoro-4-methylphenyl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | D354-0091 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(3-fluoro-4-methylphenyl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C20 H16 F N3 O2 S |
| Smiles: | [H]N(C(c1cc(c2ccc(C)c(c2)F)on1)=O)c1c(C#N)c2CCCCc2s1 |
| Stereo: | ACHIRAL |
| logP: | 5.0624 |
| logD: | 3.7714 |
| logSw: | -4.7806 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.636 |
| InChI Key: | HEGGDOQCWMBXOU-UHFFFAOYSA-N |