2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate
TL;DR: 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate (CAS 386715-39-5) is a chemical compound with molecular formula C9H16N4O3 and molecular weight 228.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-bis(dimethylamino)pyrimidine-4-carboxylic acid;hydrate
Also Known As: 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate, 2,6-bis(dimethylamino)pyrimidine-4-carboxylic Acid Hydrate, 2,6-bis(dimethylamino)pyrimidine-4-carboxylic acid;hydrate, 2,4-BIS(DIMETHYLAMINO)PYRIMIDINE-6-CARBOXYLIC ACID, HYDRATE, 2,6-bis(dimethylamino)pyrimidine-4-carboxylicAcidHydrate
| Molecular Formula | C9H16N4O3 |
|---|---|
| Molecular Weight | 228.12 g/mol |
| LogP | -0.5179 |
| Topological Polar Surface Area | 101.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.12224 |
| Heavy Atoms | 16 |
| Complexity | 352.76688 |
Chemical Identifiers
| CAS Number | 386715-39-5 |
|---|---|
| SMILES | CN(C)C1=NC(=NC(=C1)C(=O)O)N(C)C.O |
Product Overview
2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate (CAS 386715-39-5), with molecular formula C9H16N4O3 and molecular weight 228.12 g/mol. IUPAC: 2,6-bis(dimethylamino)pyrimidine-4-carboxylic acid;hydrate.
Chemical Property Profile of 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate
Property Insights of 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate
The XLogP value of -0.5179 indicates that 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate. Following Lipinski's Rule of Five, 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate has 1 hydrogen bond donor(s) and 5 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-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate?
The CAS number of 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate is 386715-39-5.
What is the molecular formula of 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate?
The molecular formula of 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate is C9H16N4O3.
What is the molecular weight of 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate?
The molecular weight of 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate is 228.12 g/mol.
Where can I buy 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate?
You can request a quote for 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Bis(dimethylamino)pyrimidine-6-carboxylic acid monohydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.