N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine
TL;DR: N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine (CAS 72186-05-1) is a chemical compound with molecular formula C26H33N3O8 and molecular weight 515.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-[[3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-(4-phenylmethoxyphenyl)propanoyl]amino]acetic acid
Also Known As: N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine, 2-[[2-[[3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-(4-phenylmethoxyphenyl)propanoyl]amino]acetic acid
| Molecular Formula | C26H33N3O8 |
|---|---|
| Molecular Weight | 515.23 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 515.22675 |
| Heavy Atoms | 37 |
| Complexity | 755.0 |
Chemical Identifiers
| CAS Number | 72186-05-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC(CO)C(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NCC(=O)O |
| InChIKey | XUXNKSWOLAUFTL-UHFFFAOYSA-N |
Product Overview
N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine (CAS 72186-05-1), with molecular formula C26H33N3O8 and molecular weight 515.23 g/mol. IUPAC: 2-[[2-[[3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-(4-phenylmethoxyphenyl)propanoyl]amino]acetic acid.
Chemical Property Profile of N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine
Property Insights of N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine. The TPSA of 163.0 Ų indicates high polarity, suggesting N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine?
The CAS number of N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine is 72186-05-1.
What is the molecular formula of N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine?
The molecular formula of N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine is C26H33N3O8.
What is the molecular weight of N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine?
The molecular weight of N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine is 515.23 g/mol.
Where can I buy N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine?
You can request a quote for N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine?
Yes, KEHONG BIO provides custom synthesis services for N-(tert-Butoxycarbonyl)seryl-O-benzyltyrosylglycine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.