![1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione structure](/static/products/406/406207-99-6.png)
1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione
TL;DR: 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione (CAS 406207-99-6) is a chemical compound with molecular formula C12H11ClN2O2 and molecular weight 250.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(chloromethyl)phenyl]methyl]pyrimidine-2,4-dione
Also Known As: phenylpyrimidine, 1-[[2-(chloromethyl)phenyl]methyl]pyrimidine-2,4-dione, 1-[2-(chloromethyl)benzyl]pyrimidine-2,4(1h,3h)-dione, 3-HYDROXY-3-PROP-2-YNYL-1,3-DIHYDRO-INDOL-2-ONE
| Molecular Formula | C12H11ClN2O2 |
|---|---|
| Molecular Weight | 250.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.0509 |
| Heavy Atoms | 17 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 406207-99-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2C=CC(=O)NC2=O)CCl |
| InChIKey | FVJWPQKWQKXGGC-UHFFFAOYSA-N |
Product Overview
1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione (CAS 406207-99-6), with molecular formula C12H11ClN2O2 and molecular weight 250.05 g/mol. IUPAC: 1-[[2-(chloromethyl)phenyl]methyl]pyrimidine-2,4-dione.
Chemical Property Profile of 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione
Property Insights of 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione. With a topological polar surface area (TPSA) of 49.4 Ų, 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione has 1 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 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione?
The CAS number of 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione is 406207-99-6.
What is the molecular formula of 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione?
The molecular formula of 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione is C12H11ClN2O2.
What is the molecular weight of 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione?
The molecular weight of 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione is 250.05 g/mol.
Where can I buy 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione?
You can request a quote for 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-(Chloromethyl)phenyl]methyl]pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.