4(1H)-Pyrimidinone, 2-amino-5-octyl-
TL;DR: 4(1H)-Pyrimidinone, 2-amino-5-octyl- (CAS 28224-67-1) is a chemical compound with molecular formula C12H21N3O and molecular weight 223.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-octyl-1H-pyrimidin-6-one
Also Known As: 4(1H)-Pyrimidinone, 2-amino-5-octyl-, 2-Amino-5-octyl-4(1H)-pyrimidinone, 2-amino-5-octyl-1H-pyrimidin-6-one, 2-Amino-5-octylpyrimidin-4(3H)-one
| Molecular Formula | C12H21N3O |
|---|---|
| Molecular Weight | 223.17 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 67.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 223.16846 |
| Heavy Atoms | 16 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 28224-67-1 |
|---|---|
| SMILES | CCCCCCCCC1=CN=C(NC1=O)N |
| InChIKey | PPSYBEVZXHJFAJ-UHFFFAOYSA-N |
Product Overview
4(1H)-Pyrimidinone, 2-amino-5-octyl- (CAS 28224-67-1), with molecular formula C12H21N3O and molecular weight 223.17 g/mol. IUPAC: 2-amino-5-octyl-1H-pyrimidin-6-one.
Chemical Property Profile of 4(1H)-Pyrimidinone, 2-amino-5-octyl-
Property Insights of 4(1H)-Pyrimidinone, 2-amino-5-octyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(1H)-Pyrimidinone, 2-amino-5-octyl-. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4(1H)-Pyrimidinone, 2-amino-5-octyl-. Following Lipinski's Rule of Five, 4(1H)-Pyrimidinone, 2-amino-5-octyl- has 2 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 4(1H)-Pyrimidinone, 2-amino-5-octyl-?
The CAS number of 4(1H)-Pyrimidinone, 2-amino-5-octyl- is 28224-67-1.
What is the molecular formula of 4(1H)-Pyrimidinone, 2-amino-5-octyl-?
The molecular formula of 4(1H)-Pyrimidinone, 2-amino-5-octyl- is C12H21N3O.
What is the molecular weight of 4(1H)-Pyrimidinone, 2-amino-5-octyl-?
The molecular weight of 4(1H)-Pyrimidinone, 2-amino-5-octyl- is 223.17 g/mol.
Where can I buy 4(1H)-Pyrimidinone, 2-amino-5-octyl-?
You can request a quote for 4(1H)-Pyrimidinone, 2-amino-5-octyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(1H)-Pyrimidinone, 2-amino-5-octyl-?
Yes, KEHONG BIO provides custom synthesis services for 4(1H)-Pyrimidinone, 2-amino-5-octyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.