2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl-
TL;DR: 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl- (CAS 16018-87-4) is a chemical compound with molecular formula C5H5ClN2O2 and molecular weight 160.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-6-methyl-1H-pyrimidine-2,4-dione
Also Known As: 5-chloro-6-methyluracil, 5-chloro-6-methyl-1H-pyrimidine-2,4-dione, 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl-, 5-Chloro-6-methylpyrimidine-2,4(1H,3H)-dione, 5-Chloro-6-methyl-2,4-pyrimidinediol
| Molecular Formula | C5H5ClN2O2 |
|---|---|
| Molecular Weight | 160.00 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.00395 |
| Heavy Atoms | 10 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 16018-87-4 |
|---|---|
| SMILES | CC1=C(C(=O)NC(=O)N1)Cl |
| InChIKey | YFTMPDGCVOWZOZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl- (CAS 16018-87-4), with molecular formula C5H5ClN2O2 and molecular weight 160.00 g/mol. IUPAC: 5-chloro-6-methyl-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl-
Property Insights of 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl-
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl-. With a topological polar surface area (TPSA) of 58.2 Ų, 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl- has 2 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 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl-?
The CAS number of 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl- is 16018-87-4.
What is the molecular formula of 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl-?
The molecular formula of 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl- is C5H5ClN2O2.
What is the molecular weight of 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl-?
The molecular weight of 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl- is 160.00 g/mol.
Where can I buy 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl-?
You can request a quote for 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.