2-{4-[di(prop-2-en-1-yl)amino]-3-nitrophenyl}hexahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{4-[di(prop-2-en-1-yl)amino]-3-nitrophenyl}hexahydro-1H-isoindole-1,3(2H)-dione
2-{4-[di(prop-2-en-1-yl)amino]-3-nitrophenyl}hexahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K807-0129 |
| Compound Name: | 2-{4-[di(prop-2-en-1-yl)amino]-3-nitrophenyl}hexahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C20 H23 N3 O4 |
| Smiles: | C=CCN(CC=C)c1ccc(cc1[N+]([O-])=O)N1C(C2CCCCC2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8821 |
| logD: | 2.8821 |
| logSw: | -3.3974 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.095 |
| InChI Key: | DDOCZJIHICZTON-UHFFFAOYSA-N |