三缩脲
TL;DR: 三缩脲 (CAS 556-99-0) is a chemical compound with molecular formula C3H6N4O3 and molecular weight 146.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三缩脲
1,3-dicarbamoylurea
Also Known As: Triuret, Carbonyldiurea, Dicarbamylurea, Diimidotricarbonic diamide, 1,3-dicarbamylurea
| Molecular Formula | C3H6N4O3 |
|---|---|
| Molecular Weight | 146.04 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 146.04399 |
| Heavy Atoms | 10 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 556-99-0 |
|---|---|
| SMILES | C(=O)(N)NC(=O)NC(=O)N |
| InChIKey | WNVQBUHCOYRLPA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三缩脲 (CAS 556-99-0), with molecular formula C3H6N4O3 and molecular weight 146.04 g/mol. IUPAC: 1,3-dicarbamoylurea.
Chemical Property Profile of 三缩脲
Property Insights of 三缩脲
The XLogP value of -1.3 indicates that 三缩脲 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 三缩脲. Following Lipinski's Rule of Five, 三缩脲 has 4 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 三缩脲?
The CAS number of 三缩脲 is 556-99-0.
What is the molecular formula of 三缩脲?
The molecular formula of 三缩脲 is C3H6N4O3.
What is the molecular weight of 三缩脲?
The molecular weight of 三缩脲 is 146.04 g/mol.
Where can I buy 三缩脲?
You can request a quote for 三缩脲 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三缩脲?
Yes, KEHONG BIO provides custom synthesis services for 三缩脲 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.