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4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid structure
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4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid

TL;DR: 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid (CAS 1396963-68-0) is a chemical compound with molecular formula C12H13ClN2O4 and molecular weight 284.0564 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-amino-2-[(4-chlorobenzoyl)amino]-5-oxopentanoic acid

Also Known As: 4-carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid, 4-Carbamoyl-2-(4-chloro-benzoylamino)-butyric acid, 5-amino-2-[(4-chlorobenzoyl)amino]-5-oxopentanoic acid, 4-carbamoyl-2-[(4-chlorobenzoyl)amino]butanoic Acid, 4-carbamoyl-2-[(4-chlorophenyl)formamido]butanoicacid

CAS Number
1396963-68-0
Molecular Formula
C12H13ClN2O4
Molecular Weight
284.0564 g/mol
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Technical Specifications

Molecular FormulaC12H13ClN2O4
Molecular Weight284.0564 g/mol
XLogP0.7
Topological Polar Surface Area (TPSA)109.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors4
Rotatable Bonds6
Exact Mass284.0564 Da
Heavy Atoms19
Complexity354.0
SMILESC1=CC(=CC=C1C(=O)NC(CCC(=O)N)C(=O)O)Cl
InChIKeyGCDAAHJGEVACOC-UHFFFAOYSA-N

Chemical Property Profile of 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid

XLogP
0.7
TPSA (Topological Polar Surface Area)
109.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
4
Rotatable Bonds
6
Heavy Atoms
19
Complexity
354.0
Exact Mass
284.0564
Monoisotopic Mass
284.0564
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 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid

The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid. Following Lipinski's Rule of Five, 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic 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

What is the CAS number of 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid?

The CAS number of 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid is 1396963-68-0.

What is the molecular formula of 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid?

The molecular formula of 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid is C12H13ClN2O4.

What is the molecular weight of 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid?

The molecular weight of 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid is 284.0564 g/mol.

Where can I buy 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid?

You can request a quote for 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid?

Yes, CoreyChem provides custom synthesis services for 4-Carbamoyl-2-[(4-chlorophenyl)formamido]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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