2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)-
TL;DR: 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)- (CAS 117011-72-0) is a chemical compound with molecular formula C8H11N3O2 and molecular weight 181.08513 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-1-[(E)-4-hydroxybut-2-enyl]pyrimidin-2-one
Also Known As: HOCH2CH=CH-CH2-cytosine, (4-Hydroxy-2-buten)cytosine (E), 1-[(E)-4-Hydroxy-2-butenyl]cytosine, 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)-, 4-amino-1-[(E)-4-hydroxybut-2-enyl]pyrimidin-2-one
Technical Specifications
| Molecular Formula | C8H11N3O2 |
| Molecular Weight | 181.08513 g/mol |
| XLogP | -1.5 |
| Topological Polar Surface Area (TPSA) | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 181.08513 Da |
| Heavy Atoms | 13 |
| Complexity | 281.0 |
| SMILES | C1=CN(C(=O)N=C1N)C/C=C/CO |
| InChIKey | HGNXPEBCWGQXGP-OWOJBTEDSA-N |
Chemical Property Profile of 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)-
Property Insights of 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)-
The XLogP value of -1.5 indicates that 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)-. Following Lipinski's Rule of Five, 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)- 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
What is the CAS number of 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)-?
The CAS number of 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)- is 117011-72-0.
What is the molecular formula of 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)-?
The molecular formula of 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)- is C8H11N3O2.
What is the molecular weight of 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)-?
The molecular weight of 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)- is 181.08513 g/mol.
Where can I buy 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)-?
You can request a quote for 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)-?
Yes, CoreyChem provides custom synthesis services for 2(1H)-Pyrimidinone, 4-amino-1-(4-hydroxy-2-butenyl)-, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.