2-amino-4-(5-ethyl-4-nitrothiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(5-ethyl-4-nitrothiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-amino-4-(5-ethyl-4-nitrothiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 3830-0881 |
| Compound Name: | 2-amino-4-(5-ethyl-4-nitrothiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 328.39 |
| Molecular Formula: | C16 H16 N4 O2 S |
| Smiles: | CCc1c(cc(c2c3CCCCc3nc(c2C#N)N)s1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0416 |
| logD: | 4.0375 |
| logSw: | -4.4424 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.856 |
| InChI Key: | FQVAGUNTXLBHMF-UHFFFAOYSA-N |