Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate
TL;DR: Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate (CAS 83026-99-7) is a chemical compound with molecular formula C13H18NO7P and molecular weight 331.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-dimethoxyphosphoryl-2-(phenylmethoxycarbonylamino)acetate
Also Known As: N-benzyloxy carbonyl, Methyl 2-(((benzyloxy)carbonyl)amino)-2-(dimethoxyphosphoryl)acetate, N-Cbz-2-phosphonoglycine Trimethyl Ester, (+/-)-BENZYLOXYCARBONYL-ALPHA-PHOSPHONOGLYCINE TRIMETHYL ESTER, Methyl N-(benzyloxycarbonyl)-2-(dimethylphosphono)glycinate
| Molecular Formula | C13H18NO7P |
|---|---|
| Molecular Weight | 331.08 g/mol |
| LogP | 1.8978 |
| Topological Polar Surface Area | 100.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 331.0821 |
| Heavy Atoms | 22 |
| Complexity | 540.5794 |
Chemical Identifiers
| CAS Number | 83026-99-7 |
|---|---|
| SMILES | COC(=O)C(NC(=O)OCC1=CC=CC=C1)P(=O)(OC)OC |
Product Overview
Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate (CAS 83026-99-7), with molecular formula C13H18NO7P and molecular weight 331.08 g/mol. IUPAC: methyl 2-dimethoxyphosphoryl-2-(phenylmethoxycarbonylamino)acetate.
Chemical Property Profile of Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate
Property Insights of Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate
The XLogP value of 1.8978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate. The TPSA of 100.16 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate. Following Lipinski's Rule of Five, Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate?
The CAS number of Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate is 83026-99-7.
What is the molecular formula of Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate?
The molecular formula of Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate is C13H18NO7P.
What is the molecular weight of Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate?
The molecular weight of Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate is 331.08 g/mol.
Where can I buy Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate?
You can request a quote for Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-{[(benzyloxy)carbonyl]amino}-2-(dimethyl phosphono)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.