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N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine
TL;DR: N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine (CAS 1007886-84-1) is a chemical compound with molecular formula C14H16N2O5S and molecular weight 324.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-3-phenylpropanoic acid
Also Known As: BAS 12738170, N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine, 2-(3,5-Dimethyl-isoxazole-4-sulfonylamino)-3-phenyl-propionic acid, 2-(3,5-dimethylisoxazole-4-sulfonamido)-3-phenylpropanoic acid, 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-3-phenylpropanoic acid
| Molecular Formula | C14H16N2O5S |
|---|---|
| Molecular Weight | 324.08 g/mol |
| LogP | 1.26564 |
| Topological Polar Surface Area | 109.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 324.078 |
| Heavy Atoms | 22 |
| Complexity | 748.2858 |
Chemical Identifiers
| CAS Number | 1007886-84-1 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)O |
Product Overview
N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine (CAS 1007886-84-1), with molecular formula C14H16N2O5S and molecular weight 324.08 g/mol. IUPAC: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-3-phenylpropanoic acid.
Chemical Property Profile of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine
Property Insights of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine
The XLogP value of 1.26564 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine. The TPSA of 109.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine. Following Lipinski's Rule of Five, N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine has 2 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 N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine?
The CAS number of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine is 1007886-84-1.
What is the molecular formula of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine?
The molecular formula of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine is C14H16N2O5S.
What is the molecular weight of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine?
The molecular weight of N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine is 324.08 g/mol.
Where can I buy N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine?
You can request a quote for N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.