methyl 2-chloro-5-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl)benzoate
Chemical Structure Depiction of
methyl 2-chloro-5-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl)benzoate
methyl 2-chloro-5-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl)benzoate
Compound characteristics
Compound ID: | 2360-0093 |
Compound Name: | methyl 2-chloro-5-(4-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl)benzoate |
Molecular Weight: | 347.75 |
Molecular Formula: | C17 H14 Cl N O5 |
Smiles: | CC12C=CC(C3C1C(N(C3=O)c1ccc(c(c1)C(=O)OC)[Cl])=O)O2 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 1.8038 |
logD: | 1.8038 |
logSw: | -2.9244 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 57.975 |
InChI Key: | FCBUFYFFWZMHFV-UHFFFAOYSA-N |