2-[3-(3,5-dichloro-2-methoxyphenyl)prop-2-enamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-[3-(3,5-dichloro-2-methoxyphenyl)prop-2-enamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-[3-(3,5-dichloro-2-methoxyphenyl)prop-2-enamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | 8016-0701 |
| Compound Name: | 2-[3-(3,5-dichloro-2-methoxyphenyl)prop-2-enamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 425.33 |
| Molecular Formula: | C19 H18 Cl2 N2 O3 S |
| Smiles: | COc1c(/C=C/C(Nc2c(C(N)=O)c3CCCCc3s2)=O)cc(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9672 |
| logD: | 3.7553 |
| logSw: | -4.4945 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.607 |
| InChI Key: | WGFOVVJLIRJBCA-UHFFFAOYSA-N |