2-amino-4-(5-tert-butylthiophen-2-yl)-1-(2,6-difluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(5-tert-butylthiophen-2-yl)-1-(2,6-difluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(5-tert-butylthiophen-2-yl)-1-(2,6-difluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8012-9568 |
| Compound Name: | 2-amino-4-(5-tert-butylthiophen-2-yl)-1-(2,6-difluorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C24 H23 F2 N3 O S |
| Smiles: | CC(C)(C)c1ccc(C2C(C#N)=C(N)N(C3CCCC(C2=3)=O)c2c(cccc2F)F)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0361 |
| logD: | 5.0361 |
| logSw: | -4.8292 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.793 |
| InChI Key: | DRIVTBWRPTYGEZ-FQEVSTJZSA-N |