![(S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid structure](/static/products/956/956777-89-2.png)
(S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid
TL;DR: (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid (CAS 956777-89-2) is a chemical compound with molecular formula C18H18N2O5 and molecular weight 342.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-phenylpropanoic acid
Also Known As: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-phenylpropanoic acid, (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid, 2-(7,10-dioxabicyclo[4.4.0]deca-2,4,11-trien-3-ylcarbamoylamino)-3-phenyl-propanoic Acid
| Molecular Formula | C18H18N2O5 |
|---|---|
| Molecular Weight | 342.12 g/mol |
| LogP | 2.2752 |
| Topological Polar Surface Area | 96.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.12158 |
| Heavy Atoms | 25 |
| Complexity | 763.31665 |
Chemical Identifiers
| CAS Number | 956777-89-2 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O |
Product Overview
(S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid (CAS 956777-89-2), with molecular formula C18H18N2O5 and molecular weight 342.12 g/mol. IUPAC: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-3-phenylpropanoic acid.
Chemical Property Profile of (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid
Property Insights of (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid
The XLogP value of 2.2752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid. The TPSA of 96.89 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid. Following Lipinski's Rule of Five, (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid has 3 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 (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid?
The CAS number of (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid is 956777-89-2.
What is the molecular formula of (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid?
The molecular formula of (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid is C18H18N2O5.
What is the molecular weight of (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid?
The molecular weight of (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid is 342.12 g/mol.
Where can I buy (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid?
You can request a quote for (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ureido)-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.