2-(4-bromobenzamido)-N-[(oxolan-2-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-(4-bromobenzamido)-N-[(oxolan-2-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-(4-bromobenzamido)-N-[(oxolan-2-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y070-1216 |
| Compound Name: | 2-(4-bromobenzamido)-N-[(oxolan-2-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 463.39 |
| Molecular Formula: | C21 H23 Br N2 O3 S |
| Smiles: | C1CCc2c(C1)c(C(NCC1CCCO1)=O)c(NC(c1ccc(cc1)[Br])=O)s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9654 |
| logD: | 0.9236 |
| logSw: | -4.4498 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.112 |
| InChI Key: | OBQDJYORCWXEHQ-OAHLLOKOSA-N |