Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-
TL;DR: Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl- (CAS 77694-27-0) is a chemical compound with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5,5-dimethyl-2-oxooxolan-3-yl)-3-phenylurea
Also Known As: 1-(5,5-Dimethyl-2-oxotetrahydro-3-furyl)-3-phenylurea, Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-, 1-(5,5-dimethyl-2-oxooxolan-3-yl)-3-phenylurea, 4-18-00-07847 (Beilstein Handbook Reference), 1-(5,5-Dimethyl-2-oxotetrahydrofuran-3-yl)-3-phenylurea
| Molecular Formula | C13H16N2O3 |
|---|---|
| Molecular Weight | 248.12 g/mol |
| LogP | 1.9022 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.11609 |
| Heavy Atoms | 18 |
| Complexity | 456.56396 |
Chemical Identifiers
| CAS Number | 77694-27-0 |
|---|---|
| SMILES | CC1(CC(C(=O)O1)NC(=O)NC2=CC=CC=C2)C |
Product Overview
Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl- (CAS 77694-27-0), with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol. IUPAC: 1-(5,5-dimethyl-2-oxooxolan-3-yl)-3-phenylurea.
Chemical Property Profile of Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-
Property Insights of Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-
The XLogP value of 1.9022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-. Following Lipinski's Rule of Five, Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl- has 2 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 Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-?
The CAS number of Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl- is 77694-27-0.
What is the molecular formula of Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-?
The molecular formula of Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl- is C13H16N2O3.
What is the molecular weight of Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-?
The molecular weight of Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl- is 248.12 g/mol.
Where can I buy Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-?
You can request a quote for Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(5,5-dimethyl-2-oxotetrahydro-3-furyl)-3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.