2-{[8-ethoxy-2-(3-methoxyphenyl)-1,3-dimethylcyclohepta[c]pyrrol-4(2H)-ylidene]amino}-4,5-dimethylaniline--perchloric acid (1/1)
Chemical Structure Depiction of
2-{[8-ethoxy-2-(3-methoxyphenyl)-1,3-dimethylcyclohepta[c]pyrrol-4(2H)-ylidene]amino}-4,5-dimethylaniline--perchloric acid (1/1)
2-{[8-ethoxy-2-(3-methoxyphenyl)-1,3-dimethylcyclohepta[c]pyrrol-4(2H)-ylidene]amino}-4,5-dimethylaniline--perchloric acid (1/1)
Compound characteristics
| Compound ID: | 4861-0247 |
| Compound Name: | 2-{[8-ethoxy-2-(3-methoxyphenyl)-1,3-dimethylcyclohepta[c]pyrrol-4(2H)-ylidene]amino}-4,5-dimethylaniline--perchloric acid (1/1) |
| Molecular Weight: | 542.03 |
| Molecular Formula: | C28 H31 N3 O2 |
| Salt: | HClO4 |
| Smiles: | CCOC1=CC=C\C(c2c1c(C)n(c1cccc(c1)OC)c2C)=N/c1cc(C)c(C)cc1N |
| Stereo: | ACHIRAL |
| logP: | 6.103 |
| logD: | 6.103 |
| logSw: | -5.6499 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.158 |
| InChI Key: | VDYBUIPSPXRAGW-BGABXYSRSA-N |