2-amino-4-{5-bromo-2-[(4-chlorophenyl)methoxy]phenyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-{5-bromo-2-[(4-chlorophenyl)methoxy]phenyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
2-amino-4-{5-bromo-2-[(4-chlorophenyl)methoxy]phenyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | Y501-9217 |
| Compound Name: | 2-amino-4-{5-bromo-2-[(4-chlorophenyl)methoxy]phenyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 482.81 |
| Molecular Formula: | C24 H21 Br Cl N3 O |
| Smiles: | C1CCc2c(c3cc(ccc3OCc3ccc(cc3)[Cl])[Br])c(C#N)c(N)nc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 6.7128 |
| logD: | 6.7127 |
| logSw: | -6.8507 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.402 |
| InChI Key: | WVLVTEVQDFBGND-UHFFFAOYSA-N |