7-nitro-N-[(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]dibenzo[b,d]furan-2-sulfonamide
Chemical Structure Depiction of
7-nitro-N-[(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]dibenzo[b,d]furan-2-sulfonamide
7-nitro-N-[(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]dibenzo[b,d]furan-2-sulfonamide
Compound characteristics
| Compound ID: | 8019-3827 |
| Compound Name: | 7-nitro-N-[(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]dibenzo[b,d]furan-2-sulfonamide |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C21 H18 N2 O5 S2 |
| Smiles: | C1CCc2c(C1)c(CNS(c1ccc3c(c1)c1ccc(cc1o3)[N+]([O-])=O)(=O)=O)cs2 |
| Stereo: | ACHIRAL |
| logP: | 5.8575 |
| logD: | 5.8572 |
| logSw: | -6.0073 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.232 |
| InChI Key: | CGRUSOAPBZKVRT-UHFFFAOYSA-N |