尿囊酸
TL;DR: 尿囊酸 (CAS 99-16-1) is a chemical compound with molecular formula C4H8N4O4 and molecular weight 176.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尿囊酸
2,2-bis(carbamoylamino)acetic acid
Also Known As: Allantoic acid, Diureidoacetic acid, allantoate, Allantoicacid, diureidoacetate
| Molecular Formula | C4H8N4O4 |
|---|---|
| Molecular Weight | 176.05 g/mol |
| LogP | -2.6 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 176.05455 |
| Heavy Atoms | 12 |
| Complexity | 199.0 |
| Melting Point | 180 - 181 °C |
Chemical Identifiers
| CAS Number | 99-16-1 |
|---|---|
| SMILES | C(C(=O)O)(NC(=O)N)NC(=O)N |
| InChIKey | NUCLJNSWZCHRKL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
尿囊酸 (CAS 99-16-1), with molecular formula C4H8N4O4 and molecular weight 176.05 g/mol. IUPAC: 2,2-bis(carbamoylamino)acetic acid.
Chemical Property Profile of 尿囊酸
Property Insights of 尿囊酸
The XLogP value of -2.6 indicates that 尿囊酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 148.0 Ų indicates high polarity, suggesting 尿囊酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 尿囊酸 has 5 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 尿囊酸?
The CAS number of 尿囊酸 is 99-16-1.
What is the molecular formula of 尿囊酸?
The molecular formula of 尿囊酸 is C4H8N4O4.
What is the molecular weight of 尿囊酸?
The molecular weight of 尿囊酸 is 176.05 g/mol.
Where can I buy 尿囊酸?
You can request a quote for 尿囊酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尿囊酸?
Yes, KEHONG BIO provides custom synthesis services for 尿囊酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.