TL;DR: N-[1,1'-Biphenyl]-2-yl-N~2~-[(3,4-dimethoxyphenyl)methyl]alaninamide (CAS 1009582-58-4) is a chemical compound with molecular formula C24H26N2O3 and molecular weight 390.19434 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3,4-dimethoxyphenyl)methylamino]-N-(2-phenylphenyl)propanamide
Also Known As: 2-[(3,4-dimethoxyphenyl)methylamino]-N-(2-phenylphenyl)propanamide, N-[1,1'-Biphenyl]-2-yl-2-[[(3,4-dimethoxyphenyl)methyl]amino]propanamide, N-[1,1'-Biphenyl]-2-yl-N~2~-[(3,4-dimethoxyphenyl)methyl]alaninamide, N-[1,1a(2)-Biphenyl]-2-yl-2-[[(3,4-dimethoxyphenyl)methyl]amino]propanamide
| Molecular Formula | C24H26N2O3 |
| Molecular Weight | 390.19434 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 59.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 390.19434 Da |
| Heavy Atoms | 29 |
| Complexity | 495.0 |
| SMILES | CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)NCC3=CC(=C(C=C3)OC)OC |
| InChIKey | FNDMLVUBFQYZIH-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that N-[1,1'-Biphenyl]-2-yl-N~2~-[(3,4-dimethoxyphenyl)methyl]alaninamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.6 Ų, N-[1,1'-Biphenyl]-2-yl-N~2~-[(3,4-dimethoxyphenyl)methyl]alaninamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[1,1'-Biphenyl]-2-yl-N~2~-[(3,4-dimethoxyphenyl)methyl]alaninamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[1,1'-Biphenyl]-2-yl-N~2~-[(3,4-dimethoxyphenyl)methyl]alaninamide is 1009582-58-4.
The molecular formula of N-[1,1'-Biphenyl]-2-yl-N~2~-[(3,4-dimethoxyphenyl)methyl]alaninamide is C24H26N2O3.
The molecular weight of N-[1,1'-Biphenyl]-2-yl-N~2~-[(3,4-dimethoxyphenyl)methyl]alaninamide is 390.19434 g/mol.
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