N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine
TL;DR: N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine (CAS 478080-91-0) is a chemical compound with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-5-methylsulfonyl-2-phenylpyrimidin-4-amine
Also Known As: N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine, 8N-586S, 5-methanesulfonyl-N,N-dimethyl-2-phenylpyrimidin-4-amine, N,N-dimethyl-5-methylsulfonyl-2-phenylpyrimidin-4-amine, N,N-dimethyl-5-methylsulfonyl-2-phenyl-pyrimidin-4-amine
| Molecular Formula | C13H15N3O2S |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 1.6131 |
| Topological Polar Surface Area | 63.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.0885 |
| Heavy Atoms | 19 |
| Complexity | 682.2894 |
Chemical Identifiers
| CAS Number | 478080-91-0 |
|---|---|
| SMILES | CN(C)C1=NC(=NC=C1S(=O)(=O)C)C2=CC=CC=C2 |
Product Overview
N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine (CAS 478080-91-0), with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol. IUPAC: N,N-dimethyl-5-methylsulfonyl-2-phenylpyrimidin-4-amine.
Chemical Property Profile of N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine
Property Insights of N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine
The XLogP value of 1.6131 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine. The TPSA of 63.16 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine. Following Lipinski's Rule of Five, N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine has 0 hydrogen bond donor(s) and 5 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 N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine?
The CAS number of N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine is 478080-91-0.
What is the molecular formula of N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine?
The molecular formula of N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine is C13H15N3O2S.
What is the molecular weight of N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine?
The molecular weight of N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine is 277.09 g/mol.
Where can I buy N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine?
You can request a quote for N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl-5-(methylsulfonyl)-2-phenyl-4-pyrimidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.