BAS 00444390
TL;DR: BAS 00444390 (CAS 32502-59-3) is a chemical compound with molecular formula C12H13N5O2 and molecular weight 259.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-6-[methyl-[(E)-pyridin-3-ylmethylideneamino]amino]-1H-pyrimidine-2,4-dione
Also Known As: BAS 00444390, 3-methyl-6-[(2E)-1-methyl-2-(pyridin-3-ylmethylidene)hydrazinyl]pyrimidine-2,4(1H,3H)-dione, (E)-3-methyl-6-(1-methyl-2-(pyridin-3-ylmethylene)hydrazinyl)pyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C12H13N5O2 |
|---|---|
| Molecular Weight | 259.11 g/mol |
| LogP | -0.0611 |
| Topological Polar Surface Area | 83.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.10693 |
| Heavy Atoms | 19 |
| Complexity | 670.7999 |
Chemical Identifiers
| CAS Number | 32502-59-3 |
|---|---|
| SMILES | CN1C(=O)C=C(NC1=O)N(C)/N=C/C2=CN=CC=C2 |
Product Overview
BAS 00444390 (CAS 32502-59-3), with molecular formula C12H13N5O2 and molecular weight 259.11 g/mol. IUPAC: 3-methyl-6-[methyl-[(E)-pyridin-3-ylmethylideneamino]amino]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of BAS 00444390
Property Insights of BAS 00444390
The XLogP value of -0.0611 indicates that BAS 00444390 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.35 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00444390. Following Lipinski's Rule of Five, BAS 00444390 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 BAS 00444390?
The CAS number of BAS 00444390 is 32502-59-3.
What is the molecular formula of BAS 00444390?
The molecular formula of BAS 00444390 is C12H13N5O2.
What is the molecular weight of BAS 00444390?
The molecular weight of BAS 00444390 is 259.11 g/mol.
Where can I buy BAS 00444390?
You can request a quote for BAS 00444390 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00444390?
Yes, KEHONG BIO provides custom synthesis services for BAS 00444390 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.