![4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid structure](/static/products/109/1099715-92-0.png)
4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid
TL;DR: 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid (CAS 1099715-92-0) is a chemical compound with molecular formula C21H22N2O5 and molecular weight 382.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(1-phenylmethoxycarbonylpyrrolidine-2-carbonyl)amino]methyl]benzoic acid
Also Known As: 4-[({1-[(benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid, 4-[[(1-phenylmethoxycarbonylpyrrolidine-2-carbonyl)amino]methyl]benzoic Acid, 4-((1-((benzyloxy)carbonyl)pyrrolidine-2-carboxamido)methyl)benzoic acid
| Molecular Formula | C21H22N2O5 |
|---|---|
| Molecular Weight | 382.15 g/mol |
| LogP | 2.8022 |
| Topological Polar Surface Area | 95.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.15286 |
| Heavy Atoms | 28 |
| Complexity | 835.6343 |
Chemical Identifiers
| CAS Number | 1099715-92-0 |
|---|---|
| SMILES | C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)C(=O)O |
Product Overview
4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid (CAS 1099715-92-0), with molecular formula C21H22N2O5 and molecular weight 382.15 g/mol. IUPAC: 4-[[(1-phenylmethoxycarbonylpyrrolidine-2-carbonyl)amino]methyl]benzoic acid.
Chemical Property Profile of 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid
Property Insights of 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid
The XLogP value of 2.8022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid. The TPSA of 95.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid. Following Lipinski's Rule of Five, 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid has 2 hydrogen bond donor(s) and 4 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 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid?
The CAS number of 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid is 1099715-92-0.
What is the molecular formula of 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid?
The molecular formula of 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid is C21H22N2O5.
What is the molecular weight of 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid?
The molecular weight of 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid is 382.15 g/mol.
Where can I buy 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid?
You can request a quote for 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[({1-[(Benzyloxy)carbonyl]prolyl}amino)methyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.