1,1,3-Trimethyl-5-phenylbiuret
TL;DR: 1,1,3-Trimethyl-5-phenylbiuret (CAS 76266-34-7) is a chemical compound with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-carbamoyl-3,3-dimethyl-1-(2-methylphenyl)urea
Also Known As: 1,1,3-Trimethyl-5-phenylbiuret, ST 281, 1,1,3-trimethyl-3-(phenylcarbamoyl)urea, 1-carbamoyl-3,3-dimethyl-1-(2-methylphenyl)urea, Imidodicarbonic diamide, N,N,2-trimethyl-N-phenyl-
| Molecular Formula | C11H15N3O2 |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.11642 |
| Heavy Atoms | 16 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 76266-34-7 |
|---|---|
| SMILES | CC1=CC=CC=C1N(C(=O)N)C(=O)N(C)C |
| InChIKey | VQBLMDMWEQYWBX-UHFFFAOYSA-N |
Product Overview
1,1,3-Trimethyl-5-phenylbiuret (CAS 76266-34-7), with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol. IUPAC: 1-carbamoyl-3,3-dimethyl-1-(2-methylphenyl)urea.
Chemical Property Profile of 1,1,3-Trimethyl-5-phenylbiuret
Property Insights of 1,1,3-Trimethyl-5-phenylbiuret
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1,3-Trimethyl-5-phenylbiuret. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1,3-Trimethyl-5-phenylbiuret. Following Lipinski's Rule of Five, 1,1,3-Trimethyl-5-phenylbiuret has 1 hydrogen bond donor(s) and 2 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 1,1,3-Trimethyl-5-phenylbiuret?
The CAS number of 1,1,3-Trimethyl-5-phenylbiuret is 76266-34-7.
What is the molecular formula of 1,1,3-Trimethyl-5-phenylbiuret?
The molecular formula of 1,1,3-Trimethyl-5-phenylbiuret is C11H15N3O2.
What is the molecular weight of 1,1,3-Trimethyl-5-phenylbiuret?
The molecular weight of 1,1,3-Trimethyl-5-phenylbiuret is 221.12 g/mol.
Where can I buy 1,1,3-Trimethyl-5-phenylbiuret?
You can request a quote for 1,1,3-Trimethyl-5-phenylbiuret directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,3-Trimethyl-5-phenylbiuret?
Yes, KEHONG BIO provides custom synthesis services for 1,1,3-Trimethyl-5-phenylbiuret and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.