N-{2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}thiophene-2-carboxamide
N-{2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8010-4243 |
| Compound Name: | N-{2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}thiophene-2-carboxamide |
| Molecular Weight: | 453.43 |
| Molecular Formula: | C17 H13 F6 N3 O S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(C(F)(F)F)(C(F)(F)F)NC(c1cccs1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.1841 |
| logD: | 0.8657 |
| logSw: | -5.334 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.316 |
| InChI Key: | XEGLTKUPVKLBRK-UHFFFAOYSA-N |