1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-
TL;DR: 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)- (CAS 87575-85-7) is a chemical compound with molecular formula C13H16N4O3S and molecular weight 308.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3-trimethyl-10-methylsulfonyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one
Also Known As: 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-, 2,2,3-trimethyl-10-methylsulfonyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one, 10-(Methanesulfonyl)-2,2,3-trimethyl-2,10-dihydro[1,3,5]triazino[1,2-a][1,3]benzimidazol-4(3H)-one, 2,10-Dihydro-10-(methylsulfonyl)-2,2,3-trimethyl-1,3,5-triazino[1,2-a]benzimidazol-4(3H)-one
| Molecular Formula | C13H16N4O3S |
|---|---|
| Molecular Weight | 308.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 308.0943 |
| Heavy Atoms | 21 |
| Complexity | 607.0 |
Chemical Identifiers
| CAS Number | 87575-85-7 |
|---|---|
| SMILES | CC1(N=C2N(C3=CC=CC=C3N2S(=O)(=O)C)C(=O)N1C)C |
| InChIKey | OTZDLXQPFZXROP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)- (CAS 87575-85-7), with molecular formula C13H16N4O3S and molecular weight 308.09 g/mol. IUPAC: 2,2,3-trimethyl-10-methylsulfonyl-[1,3,5]triazino[1,2-a]benzimidazol-4-one.
Chemical Property Profile of 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-
Property Insights of 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-. Following Lipinski's Rule of Five, 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)- has 0 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 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-?
The CAS number of 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)- is 87575-85-7.
What is the molecular formula of 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-?
The molecular formula of 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)- is C13H16N4O3S.
What is the molecular weight of 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-?
The molecular weight of 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)- is 308.09 g/mol.
Where can I buy 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-?
You can request a quote for 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Triazino(1,2-a)benzimidazol-4(3H)-one, 2,10-dihydro-2,2,3-trimethyl-10-(methylsulfonyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.