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2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid structure
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2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid

TL;DR: 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid (CAS 1396979-08-0) is a chemical compound with molecular formula C20H21ClN4O5 and molecular weight 432.12006 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid

Also Known As: 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid, 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenyl-propanoic Acid, 2-[2-(2-{[(3-chlorophenyl)amino]carbonylamino}acetylamino)acetylamino]-3-pheny lpropanoic acid

CAS Number
1396979-08-0
Molecular Formula
C20H21ClN4O5
Molecular Weight
432.12006 g/mol
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Technical Specifications

Molecular FormulaC20H21ClN4O5
Molecular Weight432.12006 g/mol
XLogP1.8
Topological Polar Surface Area (TPSA)137.0 Ų
Hydrogen Bond Donors5
Hydrogen Bond Acceptors5
Rotatable Bonds9
Exact Mass432.12006 Da
Heavy Atoms30
Complexity612.0
SMILESC1=CC=C(C=C1)CC(C(=O)O)NC(=O)CNC(=O)CNC(=O)NC2=CC(=CC=C2)Cl
InChIKeyWHBMOKUGGNCTKW-UHFFFAOYSA-N

Chemical Property Profile of 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid

XLogP
1.8
TPSA (Topological Polar Surface Area)
137.0
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
5
Rotatable Bonds
9
Heavy Atoms
30
Complexity
612.0
Exact Mass
432.12006
Monoisotopic Mass
432.12006
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid

The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid. Following Lipinski's Rule of Five, 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid has 5 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid?

The CAS number of 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid is 1396979-08-0.

What is the molecular formula of 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid?

The molecular formula of 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid is C20H21ClN4O5.

What is the molecular weight of 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid?

The molecular weight of 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid is 432.12006 g/mol.

Where can I buy 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid?

You can request a quote for 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid?

Yes, CoreyChem provides custom synthesis services for 2-[[2-[[2-[(3-chlorophenyl)carbamoylamino]acetyl]amino]acetyl]amino]-3-phenylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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