Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)-
TL;DR: Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)- (CAS 100251-48-7) is a chemical compound with molecular formula C12H19IN2O4 and molecular weight 382.03894 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2-hydroxy-3-iodopropyl)-5-pentan-2-yl-1,3-diazinane-2,4,6-trione
Also Known As: 5-(2-Hydroxy-3-iodopropyl)-5-(1-methylbutyl)barbituric acid, 4-25-00-00454 (Beilstein Handbook Reference), BARBITURIC ACID, 5-(2-HYDROXY-3-IODOPROPYL)-5-(1-METHYLBUTYL)-, Kwas 5-(alpha-metylo-butylo-)-5-(beta-hydroksy-gamma-jodo-propylo)-barbiturowy [Polish], Kwas 5-(alpha-metylo-butylo-)-5-(beta-hydroksy-gamma-jodo-propylo)-barbiturowy
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H19IN2O4 |
| Molecular Weight | 382.03894 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.03894 Da |
| Heavy Atoms | 19 |
| Complexity | 366.0 |
| SMILES | CCCC(C)C1(C(=O)NC(=O)NC1=O)CC(CI)O |
| InChIKey | XIJVVQODFOPLDI-UHFFFAOYSA-N |
Chemical Property Profile of Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)-
Property Insights of Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)-. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)-. Following Lipinski's Rule of Five, Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)- has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)-?
The CAS number of Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)- is 100251-48-7.
What is the molecular formula of Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)-?
The molecular formula of Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)- is C12H19IN2O4.
What is the molecular weight of Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)-?
The molecular weight of Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)- is 382.03894 g/mol.
Where can I buy Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)-?
You can request a quote for Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)-?
Yes, CoreyChem provides custom synthesis services for Barbituric acid, 5-(2-hydroxy-3-iodopropyl)-5-(1-methylbutyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.