(R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid
TL;DR: (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid (CAS 956186-19-9) is a chemical compound with molecular formula C23H22N4O5S and molecular weight 466.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[[(2R)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-(1H-indol-3-yl)propanoyl]amino]-3-methylsulfanylpropanoic acid
Also Known As: (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid, (2R)-2-[[(2R)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-(1H-indol-3-yl)propanoyl]amino]-3-methylsulfanylpropanoic acid, N-[(2R)-2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-3-(1H-indol-3-yl)propanoyl]-S-methyl-L-cysteine
| Molecular Formula | C23H22N4O5S |
|---|---|
| Molecular Weight | 466.13 g/mol |
| LogP | 1.8873 |
| Topological Polar Surface Area | 137.05 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 466.1311 |
| Heavy Atoms | 33 |
| Complexity | 1454.539 |
Chemical Identifiers
| CAS Number | 956186-19-9 |
|---|---|
| SMILES | CSC[C@@H](C(=O)O)NC(=O)[C@@H](CC1=CNC2=CC=CC=C21)N3C(=O)C4=CC=CC=C4NC3=O |
Product Overview
(R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid (CAS 956186-19-9), with molecular formula C23H22N4O5S and molecular weight 466.13 g/mol. IUPAC: (2R)-2-[[(2R)-2-(2,4-dioxo-1H-quinazolin-3-yl)-3-(1H-indol-3-yl)propanoyl]amino]-3-methylsulfanylpropanoic acid.
Chemical Property Profile of (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid
Property Insights of (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid
The XLogP value of 1.8873 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid. The TPSA of 137.05 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid. Following Lipinski's Rule of Five, (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid has 4 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 (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid?
The CAS number of (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid is 956186-19-9.
What is the molecular formula of (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid?
The molecular formula of (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid is C23H22N4O5S.
What is the molecular weight of (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid?
The molecular weight of (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid is 466.13 g/mol.
Where can I buy (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid?
You can request a quote for (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (R)-2-((R)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-(1H-indol-3-yl)propanamido)-3-(methylthio)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.