methyl 2-chloro-5-[1,3-dioxo-8-(propan-2-ylidene)-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzoate
Chemical Structure Depiction of
methyl 2-chloro-5-[1,3-dioxo-8-(propan-2-ylidene)-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzoate
methyl 2-chloro-5-[1,3-dioxo-8-(propan-2-ylidene)-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzoate
Compound characteristics
| Compound ID: | 8009-8486 |
| Compound Name: | methyl 2-chloro-5-[1,3-dioxo-8-(propan-2-ylidene)-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]benzoate |
| Molecular Weight: | 371.82 |
| Molecular Formula: | C20 H18 Cl N O4 |
| Smiles: | CC(C)=C1C2C=CC1C1C2C(N(C1=O)c1ccc(c(c1)C(=O)OC)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7502 |
| logD: | 2.7502 |
| logSw: | -3.6308 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.898 |
| InChI Key: | XZDFUOAIKGZJCF-UHFFFAOYSA-N |