TL;DR: 1-(4-Bromophenyl)-3-(dodecylamino)pyrrolidine-2,5-dione (CAS 1031223-59-2) is a chemical compound with molecular formula C22H33BrN2O2 and molecular weight 436.17255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-bromophenyl)-3-(dodecylamino)pyrrolidine-2,5-dione
Also Known As: 1-(4-bromophenyl)-3-(dodecylamino)pyrrolidine-2,5-dione, 1-(4-bromophenyl)-3-(dodecylamino)azolidine-2,5-dione, 1-(4-BROMOPHENYL)-3-(DODECYLAMINO)DIHYDRO-1H-PYRROLE-2,5-DIONE
| Molecular Formula | C22H33BrN2O2 |
| Molecular Weight | 436.17255 g/mol |
| XLogP | 6.7 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 436.17255 Da |
| Heavy Atoms | 27 |
| Complexity | 450.0 |
| SMILES | CCCCCCCCCCCCNC1CC(=O)N(C1=O)C2=CC=C(C=C2)Br |
| InChIKey | ZJDBJMOIQDHCPR-UHFFFAOYSA-N |
The XLogP value of 6.7 indicates that 1-(4-Bromophenyl)-3-(dodecylamino)pyrrolidine-2,5-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, 1-(4-Bromophenyl)-3-(dodecylamino)pyrrolidine-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromophenyl)-3-(dodecylamino)pyrrolidine-2,5-dione has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1-(4-Bromophenyl)-3-(dodecylamino)pyrrolidine-2,5-dione is 1031223-59-2.
The molecular formula of 1-(4-Bromophenyl)-3-(dodecylamino)pyrrolidine-2,5-dione is C22H33BrN2O2.
The molecular weight of 1-(4-Bromophenyl)-3-(dodecylamino)pyrrolidine-2,5-dione is 436.17255 g/mol.
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