N-(3,4-Dimethylbenzoyl)glycine methyl ester
TL;DR: N-(3,4-Dimethylbenzoyl)glycine methyl ester (CAS 131648-60-7) is a chemical compound with molecular formula C12H15NO3 and molecular weight 221.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[(3,4-dimethylbenzoyl)amino]acetate
Also Known As: Methyl N-(3,4-dimethylbenzoyl)glycinate, N-(3,4-Dimethylbenzoyl)glycine methyl ester, methyl 2-[(3,4-dimethylbenzoyl)amino]acetate, AB01324107-02
Technical Specifications
| Molecular Formula | C12H15NO3 |
| Molecular Weight | 221.1052 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.1052 Da |
| Heavy Atoms | 16 |
| Complexity | 265.0 |
| SMILES | CC1=C(C=C(C=C1)C(=O)NCC(=O)OC)C |
| InChIKey | NBTUZTJWTSWENT-UHFFFAOYSA-N |
Chemical Property Profile of N-(3,4-Dimethylbenzoyl)glycine methyl ester
Property Insights of N-(3,4-Dimethylbenzoyl)glycine methyl ester
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-Dimethylbenzoyl)glycine methyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, N-(3,4-Dimethylbenzoyl)glycine methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-Dimethylbenzoyl)glycine 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.
Frequently Asked Questions
What is the CAS number of N-(3,4-Dimethylbenzoyl)glycine methyl ester?
The CAS number of N-(3,4-Dimethylbenzoyl)glycine methyl ester is 131648-60-7.
What is the molecular formula of N-(3,4-Dimethylbenzoyl)glycine methyl ester?
The molecular formula of N-(3,4-Dimethylbenzoyl)glycine methyl ester is C12H15NO3.
What is the molecular weight of N-(3,4-Dimethylbenzoyl)glycine methyl ester?
The molecular weight of N-(3,4-Dimethylbenzoyl)glycine methyl ester is 221.1052 g/mol.
Where can I buy N-(3,4-Dimethylbenzoyl)glycine methyl ester?
You can request a quote for N-(3,4-Dimethylbenzoyl)glycine methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3,4-Dimethylbenzoyl)glycine methyl ester?
Yes, CoreyChem provides custom synthesis services for N-(3,4-Dimethylbenzoyl)glycine methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.