7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione
TL;DR: 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione (CAS 13401-38-2) is a chemical compound with molecular formula C7H12N4O2 and molecular weight 184.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione
Also Known As: 7-Methyl Lumazine, 7-Methylpteridine-2,4(1H,3H)-dione, 7-methylhexahydropteridine-2,4(1H,3H)-dione, 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione
| Molecular Formula | C7H12N4O2 |
|---|---|
| Molecular Weight | 184.10 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 184.09602 |
| Heavy Atoms | 13 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 13401-38-2 |
|---|---|
| SMILES | CC1CNC2C(N1)NC(=O)NC2=O |
| InChIKey | XYLXQPWBEAJZGS-UHFFFAOYSA-N |
Product Overview
7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione (CAS 13401-38-2), with molecular formula C7H12N4O2 and molecular weight 184.10 g/mol. IUPAC: 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione.
Chemical Property Profile of 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione
Property Insights of 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione
The XLogP value of -1.5 indicates that 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione. Following Lipinski's Rule of Five, 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione has 4 hydrogen bond donor(s) and 4 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 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione?
The CAS number of 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione is 13401-38-2.
What is the molecular formula of 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione?
The molecular formula of 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione is C7H12N4O2.
What is the molecular weight of 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione?
The molecular weight of 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione is 184.10 g/mol.
Where can I buy 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione?
You can request a quote for 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-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 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-methyl-4a,5,6,7,8,8a-hexahydro-1H-pteridine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.