N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(1-ethyl-1H-pyrazol-4-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(1-ethyl-1H-pyrazol-4-yl)quinoline-4-carboxamide
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(1-ethyl-1H-pyrazol-4-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y502-7321 |
| Compound Name: | N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(1-ethyl-1H-pyrazol-4-yl)quinoline-4-carboxamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C25 H23 N5 O S |
| Smiles: | CCn1cc(cn1)c1cc(C(Nc2c(C#N)c3CCC(C)Cc3s2)=O)c2ccccc2n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0818 |
| logD: | 4.1266 |
| logSw: | -5.0034 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.662 |
| InChI Key: | FBGHOXLBRYRLJO-OAHLLOKOSA-N |