2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine
TL;DR: 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine (CAS 104576-58-1) is a chemical compound with molecular formula C12H15N5 and molecular weight 229.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3-trimethyl-1H-[1,3,5]triazino[1,2-a]benzimidazol-4-imine
Also Known As: 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine, 2,2,3-trimethyl-10H-[1,3,5]triazino[1,2-a]benzimidazol-4-imine, 1,3,5-Triazino(1,2-a)benzimidazol-4(1H)-imine, 2,3-dihydro-2,3,3-trimethyl-, 2,2,3-Trimethyl-2,3-dihydro[1,3,5]triazino[1,2-a][1,3]benzimidazol-4(1H)-imine, 2,2,3-Trimethyl-2,3-dihydro[1,3,5]triazino[1,2-a]benzimidazol-4(1H)-imine
| Molecular Formula | C12H15N5 |
|---|---|
| Molecular Weight | 229.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 56.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 229.13275 |
| Heavy Atoms | 17 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 104576-58-1 |
|---|---|
| SMILES | CC1(NC2=NC3=CC=CC=C3N2C(=N)N1C)C |
| InChIKey | BJYYGUUPJTZRTB-UHFFFAOYSA-N |
Product Overview
2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine (CAS 104576-58-1), with molecular formula C12H15N5 and molecular weight 229.13 g/mol. IUPAC: 2,2,3-trimethyl-1H-[1,3,5]triazino[1,2-a]benzimidazol-4-imine.
Chemical Property Profile of 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine
Property Insights of 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine. With a topological polar surface area (TPSA) of 56.9 Ų, 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine has 2 hydrogen bond donor(s) and 3 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 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine?
The CAS number of 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine is 104576-58-1.
What is the molecular formula of 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine?
The molecular formula of 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine is C12H15N5.
What is the molecular weight of 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine?
The molecular weight of 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine is 229.13 g/mol.
Where can I buy 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine?
You can request a quote for 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine?
Yes, KEHONG BIO provides custom synthesis services for 2,3,3-Trimethyl-2,3-dihydro-1,3,5-triazino(1,2-a)benzimidazol-4(1H)-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.