2-[4-(morpholin-4-yl)-3-nitrophenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[4-(morpholin-4-yl)-3-nitrophenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
2-[4-(morpholin-4-yl)-3-nitrophenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | K807-0499 |
Compound Name: | 2-[4-(morpholin-4-yl)-3-nitrophenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
Molecular Weight: | 357.36 |
Molecular Formula: | C18 H19 N3 O5 |
Smiles: | C1C=CCC2C1C(N(C2=O)c1ccc(c(c1)[N+]([O-])=O)N1CCOCC1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 1.7454 |
logD: | 1.7454 |
logSw: | -2.4415 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 73.213 |
InChI Key: | MWLGQRNWKMPJQN-UHFFFAOYSA-N |