2-(4-{4,4-dimethyl-6-oxo-2-[(prop-2-en-1-yl)amino]cyclohex-1-en-1-yl}-4-oxobutyl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(4-{4,4-dimethyl-6-oxo-2-[(prop-2-en-1-yl)amino]cyclohex-1-en-1-yl}-4-oxobutyl)-1H-isoindole-1,3(2H)-dione
2-(4-{4,4-dimethyl-6-oxo-2-[(prop-2-en-1-yl)amino]cyclohex-1-en-1-yl}-4-oxobutyl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8015-6440 |
| Compound Name: | 2-(4-{4,4-dimethyl-6-oxo-2-[(prop-2-en-1-yl)amino]cyclohex-1-en-1-yl}-4-oxobutyl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 394.47 |
| Molecular Formula: | C23 H26 N2 O4 |
| Smiles: | CC1(C)CC(=C(C(CCCN2C(c3ccccc3C2=O)=O)=O)C(C1)=O)NCC=C |
| Stereo: | ACHIRAL |
| logP: | 2.2997 |
| logD: | 2.0216 |
| logSw: | -2.8914 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.313 |
| InChI Key: | IJHJXGCQAMOBRI-UHFFFAOYSA-N |