2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine
TL;DR: 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine (CAS 29866-25-9) is a chemical compound with molecular formula C12H13N3S and molecular weight 231.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine
Also Known As: starbld0038530, 2-Methyl-5-[(phenylsulfanyl)methyl]pyrimidin-4-amine, 2-methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine, 2-Methyl-5-((phenylthio)methyl)pyrimidin-4-amine, 2-Methyl-5-[(phenylthio)methyl]-4-pyrimidinamine
| Molecular Formula | C12H13N3S |
|---|---|
| Molecular Weight | 231.08 g/mol |
| LogP | 2.65952 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.08302 |
| Heavy Atoms | 16 |
| Complexity | 470.945 |
Chemical Identifiers
| CAS Number | 29866-25-9 |
|---|---|
| SMILES | CC1=NC=C(C(=N1)N)CSC2=CC=CC=C2 |
Product Overview
2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine (CAS 29866-25-9), with molecular formula C12H13N3S and molecular weight 231.08 g/mol. IUPAC: 2-methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine.
Chemical Property Profile of 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine
Property Insights of 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine
The XLogP value of 2.65952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine. With a topological polar surface area (TPSA) of 51.8 Ų, 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine has 1 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 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine?
The CAS number of 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine is 29866-25-9.
What is the molecular formula of 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine?
The molecular formula of 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine is C12H13N3S.
What is the molecular weight of 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine?
The molecular weight of 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine is 231.08 g/mol.
Where can I buy 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine?
You can request a quote for 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-5-(phenylsulfanylmethyl)pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.