1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione
TL;DR: 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione (CAS 85102-59-6) is a chemical compound with molecular formula C19H18N2O2 and molecular weight 306.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dibenzyl-6-methylpyrimidine-2,4-dione
Also Known As: 1,3-Dibenzyl-6-methyluracil, 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione, BAS 00389765, 1,3-dibenzyl-6-methylpyrimidine-2,4-dione, 1,3-dibenzyl-6-methyl-pyrimidin-2,4-dione
| Molecular Formula | C19H18N2O2 |
|---|---|
| Molecular Weight | 306.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 306.13684 |
| Heavy Atoms | 23 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 85102-59-6 |
|---|---|
| SMILES | CC1=CC(=O)N(C(=O)N1CC2=CC=CC=C2)CC3=CC=CC=C3 |
| InChIKey | JMEQRQUZONDCEX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione (CAS 85102-59-6), with molecular formula C19H18N2O2 and molecular weight 306.14 g/mol. IUPAC: 1,3-dibenzyl-6-methylpyrimidine-2,4-dione.
Chemical Property Profile of 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione
Property Insights of 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione. With a topological polar surface area (TPSA) of 40.6 Ų, 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione has 0 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 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione?
The CAS number of 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione is 85102-59-6.
What is the molecular formula of 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione?
The molecular formula of 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione is C19H18N2O2.
What is the molecular weight of 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione?
The molecular weight of 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione is 306.14 g/mol.
Where can I buy 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione?
You can request a quote for 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-dibenzyl-6-methylpyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.