6-(benzylamino)-1H-pyrimidin-2-one
TL;DR: 6-(benzylamino)-1H-pyrimidin-2-one (CAS 5785-16-0) is a chemical compound with molecular formula C11H11N3O and molecular weight 201.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(benzylamino)-1H-pyrimidin-2-one
Also Known As: n-benzylcytosine, 4-Benzylaminocytosine, 6-(benzylamino)-1H-pyrimidin-2-one, 4-(benzylamino)-2-pyrimidinol, 4-(benzylamino)-pyrimidin-2-ol
| Molecular Formula | C11H11N3O |
|---|---|
| Molecular Weight | 201.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 53.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.09021 |
| Heavy Atoms | 15 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 5785-16-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=CC=NC(=O)N2 |
| InChIKey | LHOUXFCFCBCKPY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-(benzylamino)-1H-pyrimidin-2-one (CAS 5785-16-0), with molecular formula C11H11N3O and molecular weight 201.09 g/mol. IUPAC: 6-(benzylamino)-1H-pyrimidin-2-one.
Chemical Property Profile of 6-(benzylamino)-1H-pyrimidin-2-one
Property Insights of 6-(benzylamino)-1H-pyrimidin-2-one
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(benzylamino)-1H-pyrimidin-2-one. With a topological polar surface area (TPSA) of 53.5 Ų, 6-(benzylamino)-1H-pyrimidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(benzylamino)-1H-pyrimidin-2-one 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 6-(benzylamino)-1H-pyrimidin-2-one?
The CAS number of 6-(benzylamino)-1H-pyrimidin-2-one is 5785-16-0.
What is the molecular formula of 6-(benzylamino)-1H-pyrimidin-2-one?
The molecular formula of 6-(benzylamino)-1H-pyrimidin-2-one is C11H11N3O.
What is the molecular weight of 6-(benzylamino)-1H-pyrimidin-2-one?
The molecular weight of 6-(benzylamino)-1H-pyrimidin-2-one is 201.09 g/mol.
Where can I buy 6-(benzylamino)-1H-pyrimidin-2-one?
You can request a quote for 6-(benzylamino)-1H-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 6-(benzylamino)-1H-pyrimidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(benzylamino)-1H-pyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.