2-amino-1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-methyl-4,4-bis(trifluoromethyl)-1,4-dihydropyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-methyl-4,4-bis(trifluoromethyl)-1,4-dihydropyridine-3-carbonitrile
2-amino-1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-methyl-4,4-bis(trifluoromethyl)-1,4-dihydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8010-4084 |
| Compound Name: | 2-amino-1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-methyl-4,4-bis(trifluoromethyl)-1,4-dihydropyridine-3-carbonitrile |
| Molecular Weight: | 432.39 |
| Molecular Formula: | C18 H14 F6 N4 S |
| Smiles: | CC1=CC(C(C#N)=C(N)N1c1c(C#N)c2CCCCc2s1)(C(F)(F)F)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.5498 |
| logD: | 4.5498 |
| logSw: | -4.6236 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.93 |
| InChI Key: | HTIYVXLKEDFKGO-UHFFFAOYSA-N |