1-(Propan-2-yl)-1,3-diazinane-2,4-dione
TL;DR: 1-(Propan-2-yl)-1,3-diazinane-2,4-dione (CAS 70729-88-3) is a chemical compound with molecular formula C7H12N2O2 and molecular weight 156.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propan-2-yl-1,3-diazinane-2,4-dione
Also Known As: 1-isopropyldihydropyrimidine-2,4(1h,3h)-dione, NCIOpen2_000736, 1-(propan-2-yl)-1,3-diazinane-2,4-dione, 1-propan-2-yl-1,3-diazinane-2,4-dione, 1-isopropylhexahydropyrimidine-2,4-dione
| Molecular Formula | C7H12N2O2 |
|---|---|
| Molecular Weight | 156.09 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.08987 |
| Heavy Atoms | 11 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 70729-88-3 |
|---|---|
| SMILES | CC(C)N1CCC(=O)NC1=O |
| InChIKey | UUTAKONPWRIWRH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Propan-2-yl)-1,3-diazinane-2,4-dione (CAS 70729-88-3), with molecular formula C7H12N2O2 and molecular weight 156.09 g/mol. IUPAC: 1-propan-2-yl-1,3-diazinane-2,4-dione.
Chemical Property Profile of 1-(Propan-2-yl)-1,3-diazinane-2,4-dione
Property Insights of 1-(Propan-2-yl)-1,3-diazinane-2,4-dione
The XLogP value of -0.2 indicates that 1-(Propan-2-yl)-1,3-diazinane-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.4 Ų, 1-(Propan-2-yl)-1,3-diazinane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Propan-2-yl)-1,3-diazinane-2,4-dione 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-(Propan-2-yl)-1,3-diazinane-2,4-dione?
The CAS number of 1-(Propan-2-yl)-1,3-diazinane-2,4-dione is 70729-88-3.
What is the molecular formula of 1-(Propan-2-yl)-1,3-diazinane-2,4-dione?
The molecular formula of 1-(Propan-2-yl)-1,3-diazinane-2,4-dione is C7H12N2O2.
What is the molecular weight of 1-(Propan-2-yl)-1,3-diazinane-2,4-dione?
The molecular weight of 1-(Propan-2-yl)-1,3-diazinane-2,4-dione is 156.09 g/mol.
Where can I buy 1-(Propan-2-yl)-1,3-diazinane-2,4-dione?
You can request a quote for 1-(Propan-2-yl)-1,3-diazinane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Propan-2-yl)-1,3-diazinane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(Propan-2-yl)-1,3-diazinane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.