Methyl 2-(benzylamino)-2-phenylacetate
TL;DR: Methyl 2-(benzylamino)-2-phenylacetate (CAS 121440-91-3) is a chemical compound with molecular formula C16H17NO2 and molecular weight 255.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-(benzylamino)-2-phenylacetate
Also Known As: methyl (benzylamino)(phenyl)acetate, methyl 2-(benzylamino)-2-phenylacetate, CHEMBRDG-BB6958578, CHEMBRDG-BB 6958578, (2S)-Benzylamino-phenyl-acetic acid methyl ester
Technical Specifications
| Molecular Formula | C16H17NO2 |
| Molecular Weight | 255.12593 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 255.12593 Da |
| Heavy Atoms | 19 |
| Complexity | 268.0 |
| SMILES | COC(=O)C(C1=CC=CC=C1)NCC2=CC=CC=C2 |
| InChIKey | BKILDAUSVSANBG-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 2-(benzylamino)-2-phenylacetate
Property Insights of Methyl 2-(benzylamino)-2-phenylacetate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(benzylamino)-2-phenylacetate. With a topological polar surface area (TPSA) of 38.3 Ų, Methyl 2-(benzylamino)-2-phenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(benzylamino)-2-phenylacetate 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 Methyl 2-(benzylamino)-2-phenylacetate?
The CAS number of Methyl 2-(benzylamino)-2-phenylacetate is 121440-91-3.
What is the molecular formula of Methyl 2-(benzylamino)-2-phenylacetate?
The molecular formula of Methyl 2-(benzylamino)-2-phenylacetate is C16H17NO2.
What is the molecular weight of Methyl 2-(benzylamino)-2-phenylacetate?
The molecular weight of Methyl 2-(benzylamino)-2-phenylacetate is 255.12593 g/mol.
Where can I buy Methyl 2-(benzylamino)-2-phenylacetate?
You can request a quote for Methyl 2-(benzylamino)-2-phenylacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-(benzylamino)-2-phenylacetate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-(benzylamino)-2-phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.