2-[3-(2-chlorophenyl)-2-cyanoprop-2-enamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-[3-(2-chlorophenyl)-2-cyanoprop-2-enamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-[3-(2-chlorophenyl)-2-cyanoprop-2-enamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | 3772-7743 |
| Compound Name: | 2-[3-(2-chlorophenyl)-2-cyanoprop-2-enamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 385.87 |
| Molecular Formula: | C19 H16 Cl N3 O2 S |
| Smiles: | C1CCc2c(C1)c(C(N)=O)c(NC(C(=C\c1ccccc1[Cl])\C#N)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.9383 |
| logD: | -0.8387 |
| logSw: | -3.8509 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.16 |
| InChI Key: | PQLOINZKDRDOLA-UHFFFAOYSA-N |