N-[(3-fluorophenyl)methyl]-2-(1H-tetrazol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-[(3-fluorophenyl)methyl]-2-(1H-tetrazol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-[(3-fluorophenyl)methyl]-2-(1H-tetrazol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y040-5964 |
| Compound Name: | N-[(3-fluorophenyl)methyl]-2-(1H-tetrazol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C17 H16 F N5 O S |
| Smiles: | C1CCc2c(C1)c(C(NCc1cccc(c1)F)=O)c(n1cnnn1)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.2924 |
| logD: | 3.2924 |
| logSw: | -3.7421 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.407 |
| InChI Key: | HYKWQVPGXCIFSX-UHFFFAOYSA-N |