TL;DR: BRN 0465854 (CAS 40714-43-0) is a chemical compound with molecular formula C30H37N3O3 and molecular weight 487.28348 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-(diethylamino)ethyl]-1-[(2,3-dimethoxyphenyl)methyl-methylamino]-3-phenylindol-2-one
Also Known As: 3-1-[methylamino]-3-phenyl-2-indolinone, 5-22-13-00143 (Beilstein Handbook Reference), 3- -1-[ methylamino]-3-phenyl-2-indolinone, 2-Indolinone, 3-(2-(diethylamino)ethyl)-1-((2,3-dimethoxybenzyl)methylamino)-3-phenyl-, 3-(2-(Diethylamino)ethyl)-1-((2,3-dimethoxybenzyl)methylamino)-3-phenyl-2-indolinone
| Molecular Formula | C30H37N3O3 |
| Molecular Weight | 487.28348 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 487.28348 Da |
| Heavy Atoms | 36 |
| Complexity | 695.0 |
| SMILES | CCN(CC)CCC1(C2=CC=CC=C2N(C1=O)N(C)CC3=C(C(=CC=C3)OC)OC)C4=CC=CC=C4 |
| InChIKey | QAHNYLOWHSOTJP-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that BRN 0465854 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, BRN 0465854 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BRN 0465854 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of BRN 0465854 is 40714-43-0.
The molecular formula of BRN 0465854 is C30H37N3O3.
The molecular weight of BRN 0465854 is 487.28348 g/mol.
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