![1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one structure](/static/products/996/99645-86-0.png)
1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one
TL;DR: 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one (CAS 99645-86-0) is a chemical compound with molecular formula C7H11N3O and molecular weight 153.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,4,6,7,8-hexahydropyrimido[1,2-a]pyrimidin-2-one
Also Known As: 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one, 1,3,4,6,7,8-hexahydropyrimido[1,2-a]pyrimidin-2-one, 1,5,7-triazabicyclo[4.4.0]dec-6-en-4-one, 1H,2H,3H,4H,6H,7H,8H-[1,3]diazino[1,2-a]pyrimidin-2-one
| Molecular Formula | C7H11N3O |
|---|---|
| Molecular Weight | 153.09 g/mol |
| LogP | -0.432 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 153.09021 |
| Heavy Atoms | 11 |
| Complexity | 211.73123 |
Chemical Identifiers
| CAS Number | 99645-86-0 |
|---|---|
| SMILES | C1CN=C2NC(=O)CCN2C1 |
Product Overview
1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one (CAS 99645-86-0), with molecular formula C7H11N3O and molecular weight 153.09 g/mol. IUPAC: 1,3,4,6,7,8-hexahydropyrimido[1,2-a]pyrimidin-2-one.
Chemical Property Profile of 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one
Property Insights of 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one
The XLogP value of -0.432 indicates that 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.7 Ų, 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one 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 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one?
The CAS number of 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one is 99645-86-0.
What is the molecular formula of 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one?
The molecular formula of 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one is C7H11N3O.
What is the molecular weight of 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one?
The molecular weight of 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one is 153.09 g/mol.
Where can I buy 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one?
You can request a quote for 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.