1-(5-bromothiophen-2-yl)-N-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)methanimine
Chemical Structure Depiction of
1-(5-bromothiophen-2-yl)-N-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)methanimine
1-(5-bromothiophen-2-yl)-N-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)methanimine
Compound characteristics
| Compound ID: | K066-0038 |
| Compound Name: | 1-(5-bromothiophen-2-yl)-N-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)methanimine |
| Molecular Weight: | 456.35 |
| Molecular Formula: | C19 H22 Br N O5 S |
| Smiles: | C1COCCOc2ccc(cc2OCCOCCO1)/N=C\c1ccc(s1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.5973 |
| logD: | 2.5972 |
| logSw: | -2.8739 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.264 |
| InChI Key: | OFHQKFVVBHSACG-UHFFFAOYSA-N |