TL;DR: 2-[2-(dimethylamino)ethyl]-6-methoxy-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione (CAS 879563-19-6) is a chemical compound with molecular formula C22H21N3O6 and molecular weight 423.14304 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(dimethylamino)ethyl]-6-methoxy-1-(4-nitrophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
Also Known As: 2-[2-(dimethylamino)ethyl]-6-methoxy-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione, 2-(2-dimethylaminoethyl)-6-methoxy-1-(4-nitrophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione, 2-(2-(dimethylamino)ethyl)-6-methoxy-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
| Molecular Formula | C22H21N3O6 |
| Molecular Weight | 423.14304 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.14304 Da |
| Heavy Atoms | 31 |
| Complexity | 768.0 |
| SMILES | CN(C)CCN1C(C2=C(C1=O)OC3=C(C2=O)C=CC(=C3)OC)C4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | ZNWXXNPNQIJFOQ-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(dimethylamino)ethyl]-6-methoxy-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(dimethylamino)ethyl]-6-methoxy-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione. Following Lipinski's Rule of Five, 2-[2-(dimethylamino)ethyl]-6-methoxy-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[2-(dimethylamino)ethyl]-6-methoxy-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione is 879563-19-6.
The molecular formula of 2-[2-(dimethylamino)ethyl]-6-methoxy-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione is C22H21N3O6.
The molecular weight of 2-[2-(dimethylamino)ethyl]-6-methoxy-1-(4-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione is 423.14304 g/mol.
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