N-Benzoyl-3-thiophen-3-ylalanine
TL;DR: N-Benzoyl-3-thiophen-3-ylalanine (CAS 69935-11-1) is a chemical compound with molecular formula C14H13NO3S and molecular weight 275.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzamido-3-thiophen-3-ylpropanoic acid
Also Known As: N-Benzoyl-3-thiophen-3-ylalanine, N-Benzoyl-3-(thiophen-3-yl)alanine, 2-benzamido-3-thiophen-3-ylpropanoic acid, 2-benzamido-3-thiophen-3-yl-propanoic acid
| Molecular Formula | C14H13NO3S |
|---|---|
| Molecular Weight | 275.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 94.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.0616 |
| Heavy Atoms | 19 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 69935-11-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(CC2=CSC=C2)C(=O)O |
| InChIKey | AXJJASXWAKRRFH-UHFFFAOYSA-N |
Product Overview
N-Benzoyl-3-thiophen-3-ylalanine (CAS 69935-11-1), with molecular formula C14H13NO3S and molecular weight 275.06 g/mol. IUPAC: 2-benzamido-3-thiophen-3-ylpropanoic acid.
Chemical Property Profile of N-Benzoyl-3-thiophen-3-ylalanine
Property Insights of N-Benzoyl-3-thiophen-3-ylalanine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzoyl-3-thiophen-3-ylalanine. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Benzoyl-3-thiophen-3-ylalanine. Following Lipinski's Rule of Five, N-Benzoyl-3-thiophen-3-ylalanine 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 N-Benzoyl-3-thiophen-3-ylalanine?
The CAS number of N-Benzoyl-3-thiophen-3-ylalanine is 69935-11-1.
What is the molecular formula of N-Benzoyl-3-thiophen-3-ylalanine?
The molecular formula of N-Benzoyl-3-thiophen-3-ylalanine is C14H13NO3S.
What is the molecular weight of N-Benzoyl-3-thiophen-3-ylalanine?
The molecular weight of N-Benzoyl-3-thiophen-3-ylalanine is 275.06 g/mol.
Where can I buy N-Benzoyl-3-thiophen-3-ylalanine?
You can request a quote for N-Benzoyl-3-thiophen-3-ylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzoyl-3-thiophen-3-ylalanine?
Yes, KEHONG BIO provides custom synthesis services for N-Benzoyl-3-thiophen-3-ylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.