1-{3-nitro-4-[(quinolin-5-yl)sulfanyl]phenyl}-N-[4-(octyloxy)phenyl]methanimine
Chemical Structure Depiction of
1-{3-nitro-4-[(quinolin-5-yl)sulfanyl]phenyl}-N-[4-(octyloxy)phenyl]methanimine
1-{3-nitro-4-[(quinolin-5-yl)sulfanyl]phenyl}-N-[4-(octyloxy)phenyl]methanimine
Compound characteristics
| Compound ID: | 8008-5739 |
| Compound Name: | 1-{3-nitro-4-[(quinolin-5-yl)sulfanyl]phenyl}-N-[4-(octyloxy)phenyl]methanimine |
| Molecular Weight: | 513.66 |
| Molecular Formula: | C30 H31 N3 O3 S |
| Smiles: | CCCCCCCCOc1ccc(cc1)/N=C/c1ccc(c(c1)[N+]([O-])=O)Sc1cccc2c1cccn2 |
| Stereo: | ACHIRAL |
| logP: | 9.2867 |
| logD: | 9.2857 |
| logSw: | -5.9823 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.355 |
| InChI Key: | PITCHTJKRRYKFG-UHFFFAOYSA-N |