![[4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol structure](/static/products/105/105106-03-4.webp)
[4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol
TL;DR: [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol (CAS 105106-03-4) is a chemical compound with molecular formula C12H12ClN3O and molecular weight 249.0669 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(2-chloroanilino)-2-methylpyrimidin-5-yl]methanol
Also Known As: [4-(2-chloro-anilino)-2-methyl-pyrimidin-5-yl]-methanol|[4-(2-chloroanilino)-2-methylpyrimidin-5-yl]methanol|NSC165333
Technical Specifications
| Molecular Formula | C12H12ClN3O |
| Molecular Weight | 249.0669 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 58.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.0669 Da |
| Heavy Atoms | 17 |
| Complexity | 242.0 |
| SMILES | CC1=NC=C(C(=N1)NC2=CC=CC=C2Cl)CO |
| InChIKey | FNTHWOWCMPIMBQ-UHFFFAOYSA-N |
Chemical Property Profile of [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol
Property Insights of [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol. With a topological polar surface area (TPSA) of 58.0 Ų, [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol?
The CAS number of [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol is 105106-03-4.
What is the molecular formula of [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol?
The molecular formula of [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol is C12H12ClN3O.
What is the molecular weight of [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol?
The molecular weight of [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol is 249.0669 g/mol.
Where can I buy [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol?
You can request a quote for [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol?
Yes, CoreyChem provides custom synthesis services for [4-(2-Chloroanilino)-2-methylpyrimidin-5-yl]methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.