ethyl 6-amino-4-(2-bromophenyl)-5-cyano-2-({[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}methyl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-4-(2-bromophenyl)-5-cyano-2-({[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}methyl)-4H-pyran-3-carboxylate
ethyl 6-amino-4-(2-bromophenyl)-5-cyano-2-({[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}methyl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8003-6088 |
| Compound Name: | ethyl 6-amino-4-(2-bromophenyl)-5-cyano-2-({[3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}methyl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 633.59 |
| Molecular Formula: | C30 H25 Br N4 O3 S2 |
| Smiles: | CCOC(C1C(C(C#N)=C(N)OC=1CSc1c(C#N)c(c2CCCCc2n1)c1cccs1)c1ccccc1[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7787 |
| logD: | 6.7787 |
| logSw: | -5.7824 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.341 |
| InChI Key: | MFTBNKQPPKYORC-AREMUKBSSA-N |