Carbamyl citrulline
TL;DR: Carbamyl citrulline (CAS 117920-63-5) is a chemical compound with molecular formula C7H14N4O4 and molecular weight 218.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2,5-bis(carbamoylamino)pentanoic acid
Also Known As: carbamyl citrulline, 2,5-diureidopentanoic acid, 2,5-bis(carbamoylamino)pentanoic Acid, (2S)-2,5-bis(carbamoylamino)pentanoic acid
| Molecular Formula | C7H14N4O4 |
|---|---|
| Molecular Weight | 218.10 g/mol |
| LogP | -1.4436 |
| Topological Polar Surface Area | 147.54 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 218.1015 |
| Heavy Atoms | 15 |
| Complexity | 255.37474 |
Chemical Identifiers
| CAS Number | 117920-63-5 |
|---|---|
| SMILES | C(C[C@@H](C(=O)O)NC(=O)N)CNC(=O)N |
Product Overview
Carbamyl citrulline (CAS 117920-63-5), with molecular formula C7H14N4O4 and molecular weight 218.10 g/mol. IUPAC: (2S)-2,5-bis(carbamoylamino)pentanoic acid.
Chemical Property Profile of Carbamyl citrulline
Property Insights of Carbamyl citrulline
The XLogP value of -1.4436 indicates that Carbamyl citrulline is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.54 Ų indicates high polarity, suggesting Carbamyl citrulline may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Carbamyl citrulline has 5 hydrogen bond donor(s) and 3 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 Carbamyl citrulline?
The CAS number of Carbamyl citrulline is 117920-63-5.
What is the molecular formula of Carbamyl citrulline?
The molecular formula of Carbamyl citrulline is C7H14N4O4.
What is the molecular weight of Carbamyl citrulline?
The molecular weight of Carbamyl citrulline is 218.10 g/mol.
Where can I buy Carbamyl citrulline?
You can request a quote for Carbamyl citrulline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamyl citrulline?
Yes, KEHONG BIO provides custom synthesis services for Carbamyl citrulline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.