3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid
TL;DR: 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid (CAS 62778-08-9) is a chemical compound with molecular formula C15H22N2O6S and molecular weight 358.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methylphenyl)sulfonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: Boc-(S)-3-amino-2-(p-toluenesulfonylamino)propionic acid, Boc-(S)-3-amino-2-(p-toluenesulfonylamino)-propionic acid, (S)-BOC-3-AMINO-2-(P-TOLUENESULFONYLAMINO)-PROPIONICACID, 2-[(4-methylphenyl)sulfonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic Acid, 3-(tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid
| Molecular Formula | C15H22N2O6S |
|---|---|
| Molecular Weight | 358.12 g/mol |
| LogP | 1.25122 |
| Topological Polar Surface Area | 121.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.11984 |
| Heavy Atoms | 24 |
| Complexity | 691.6696 |
Chemical Identifiers
| CAS Number | 62778-08-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(CNC(=O)OC(C)(C)C)C(=O)O |
Product Overview
3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid (CAS 62778-08-9), with molecular formula C15H22N2O6S and molecular weight 358.12 g/mol. IUPAC: 2-[(4-methylphenyl)sulfonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid.
Chemical Property Profile of 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid
Property Insights of 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid
The XLogP value of 1.25122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid. The TPSA of 121.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid. Following Lipinski's Rule of Five, 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid has 3 hydrogen bond donor(s) and 5 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 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid?
The CAS number of 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid is 62778-08-9.
What is the molecular formula of 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid?
The molecular formula of 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid is C15H22N2O6S.
What is the molecular weight of 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid?
The molecular weight of 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid is 358.12 g/mol.
Where can I buy 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid?
You can request a quote for 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Tert-butoxycarbonylamino)-2-(p-tolylsulfonylamino)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.