butyl [1-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)ethyl]carbamate
Chemical Structure Depiction of
butyl [1-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)ethyl]carbamate
butyl [1-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)ethyl]carbamate
Compound characteristics
| Compound ID: | 5988-0094 |
| Compound Name: | butyl [1-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)ethyl]carbamate |
| Molecular Weight: | 306.36 |
| Molecular Formula: | C16 H22 N2 O4 |
| Smiles: | CCCCOC(NC(C)N1C(C2C3CC(C=C3)C2C1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0453 |
| logD: | 2.0449 |
| logSw: | -2.2193 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.368 |
| InChI Key: | NDKKVNGIBAMTOV-UHFFFAOYSA-N |