2'-[(E)-({3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl}methylidene)amino]-3'a,4',7',7'a-tetrahydro-1'H-spiro[cyclopropane-1,8'-[4,7]methanoisoindole]-1',3'(2'H)-dione
Chemical Structure Depiction of
2'-[(E)-({3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl}methylidene)amino]-3'a,4',7',7'a-tetrahydro-1'H-spiro[cyclopropane-1,8'-[4,7]methanoisoindole]-1',3'(2'H)-dione
2'-[(E)-({3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl}methylidene)amino]-3'a,4',7',7'a-tetrahydro-1'H-spiro[cyclopropane-1,8'-[4,7]methanoisoindole]-1',3'(2'H)-dione
Compound characteristics
| Compound ID: | 8007-5547 |
| Compound Name: | 2'-[(E)-({3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl}methylidene)amino]-3'a,4',7',7'a-tetrahydro-1'H-spiro[cyclopropane-1,8'-[4,7]methanoisoindole]-1',3'(2'H)-dione |
| Molecular Weight: | 473.48 |
| Molecular Formula: | C26 H23 N3 O6 |
| Smiles: | COc1cc(/C=N/N2C(C3C(C4C=CC3C43CC3)C2=O)=O)ccc1OCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4063 |
| logD: | 2.4063 |
| logSw: | -2.786 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.329 |
| InChI Key: | JEQXBWDNOYTPNI-UHFFFAOYSA-N |