TL;DR: Glycine, N-(4-bromobenzoyl)-, methyl ester (CAS 138119-50-3) is a chemical compound with molecular formula C10H10BrNO3 and molecular weight 270.9844 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[(4-bromobenzoyl)amino]acetate
Also Known As: N-(4-Bromobenzoyl)glycine methyl ester, methyl 2-(4-bromobenzamido)acetate, Glycine, N-(4-bromobenzoyl)-, methyl ester, methyl 2-[(4-bromophenyl)formamido]acetate, methyl 2-[(4-bromobenzoyl)amino]acetate
| Molecular Formula | C10H10BrNO3 |
| Molecular Weight | 270.9844 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.9844 Da |
| Heavy Atoms | 15 |
| Complexity | 237.0 |
| SMILES | COC(=O)CNC(=O)C1=CC=C(C=C1)Br |
| InChIKey | BFHPUFUZMOHHQO-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Glycine, N-(4-bromobenzoyl)-, methyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, Glycine, N-(4-bromobenzoyl)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Glycine, N-(4-bromobenzoyl)-, methyl ester has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Glycine, N-(4-bromobenzoyl)-, methyl ester is 138119-50-3.
The molecular formula of Glycine, N-(4-bromobenzoyl)-, methyl ester is C10H10BrNO3.
The molecular weight of Glycine, N-(4-bromobenzoyl)-, methyl ester is 270.9844 g/mol.
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