6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione
TL;DR: 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione (CAS 4336-85-0) is a chemical compound with molecular formula C9H14N2O3 and molecular weight 198.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dimethyl-5-propan-2-yl-1,3-diazinane-2,4,6-trione
Also Known As: 1,5-Dimethyl-5-isopropylbarbituric acid, BARBITURIC ACID, 1,5-DIMETHYL-5-ISOPROPYL-, Barbituric acid, 5-isopropyl-1,5-dimethyl-, 5-24-09-00136 (Beilstein Handbook Reference), 1,5-dimethyl-5-propan-2-yl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C9H14N2O3 |
|---|---|
| Molecular Weight | 198.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.10045 |
| Heavy Atoms | 14 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 4336-85-0 |
|---|---|
| SMILES | CC(C)C1(C(=O)NC(=O)N(C1=O)C)C |
| InChIKey | ALVDHBGUJHQGNC-UHFFFAOYSA-N |
Product Overview
6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione (CAS 4336-85-0), with molecular formula C9H14N2O3 and molecular weight 198.10 g/mol. IUPAC: 1,5-dimethyl-5-propan-2-yl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione
Property Insights of 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione. Following Lipinski's Rule of Five, 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione has 1 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 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione?
The CAS number of 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione is 4336-85-0.
What is the molecular formula of 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione?
The molecular formula of 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione is C9H14N2O3.
What is the molecular weight of 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione?
The molecular weight of 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione is 198.10 g/mol.
Where can I buy 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione?
You can request a quote for 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxy-3,5-dimethyl-5-(propan-2-yl)pyrimidine-2,4(3H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.