TL;DR: (4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-butylphenyl)methanone (CAS 1212418-05-7) is a chemical compound with molecular formula C29H34N2O and molecular weight 426.26712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-butylphenyl)methanone
Also Known As: (4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-butylphenyl)methanone, (4-butylphenyl)(2-ethyl-3-methyl-4-(phenylamino)-3,4-dihydroquinolin-1(2H)-yl)methanone
| Molecular Formula | C29H34N2O |
| Molecular Weight | 426.26712 g/mol |
| XLogP | 7.9 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 426.26712 Da |
| Heavy Atoms | 32 |
| Complexity | 578.0 |
| SMILES | CCCCC1=CC=C(C=C1)C(=O)N2C(C(C(C3=CC=CC=C32)NC4=CC=CC=C4)C)CC |
| InChIKey | LSVVQGOVNUXOAF-UHFFFAOYSA-N |
The XLogP value of 7.9 indicates that (4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-butylphenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, (4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-butylphenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-butylphenyl)methanone has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-butylphenyl)methanone is 1212418-05-7.
The molecular formula of (4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-butylphenyl)methanone is C29H34N2O.
The molecular weight of (4-anilino-2-ethyl-3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(4-butylphenyl)methanone is 426.26712 g/mol.
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