6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one
TL;DR: 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one (CAS 98159-91-2) is a chemical compound with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-5-(3-methylanilino)-1H-pyrimidin-6-one
Also Known As: 4-hydroxy-5-(3-methylanilino)-1H-pyrimidin-6-one, 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one, 6-hydroxy-5-[(3-methylphenyl)amino]pyrimidin-4(3h)-one, 4,6-Pyrimidinediol, 5-m-toluidino- (7CI,8CI), 6-Hydroxy-5-(3-methylanilino)pyrimidin-4(3H)-one
| Molecular Formula | C11H11N3O2 |
|---|---|
| Molecular Weight | 217.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 73.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.08513 |
| Heavy Atoms | 16 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 98159-91-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC2=C(N=CNC2=O)O |
| InChIKey | SGWSEJNOAIIBEF-UHFFFAOYSA-N |
Product Overview
6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one (CAS 98159-91-2), with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol. IUPAC: 4-hydroxy-5-(3-methylanilino)-1H-pyrimidin-6-one.
Chemical Property Profile of 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one
Property Insights of 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one. Following Lipinski's Rule of Five, 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one has 3 hydrogen bond donor(s) and 4 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-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one?
The CAS number of 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one is 98159-91-2.
What is the molecular formula of 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one?
The molecular formula of 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one is C11H11N3O2.
What is the molecular weight of 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one?
The molecular weight of 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one is 217.09 g/mol.
Where can I buy 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one?
You can request a quote for 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxy-5-(m-tolylamino)pyrimidin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.