3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid
TL;DR: 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid (CAS 160205-15-2) is a chemical compound with molecular formula C7H9N3O2 and molecular weight 167.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole-5-carboxylic acid
Also Known As: 3-Methyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole-5-carboxylic acid, 3-METHYL-5H,6H,7H-PYRROLO[2,1-C][1,2,4]TRIAZOLE-5-CARBOXYLIC ACID, 5H-Pyrrolo[2,1-c]-1,2,4-triazole-5-carboxylic acid, 6,7-dihydro-3-methyl-, 5H-Pyrrolo[2,1-c]-1,2,4-triazole-5-carboxylicacid,6,7-dihydro-3-methyl-(9CI), 2-methyl-1,3,4-triazabicyclo[3.3.0]octa-2,4-diene-8-carboxylic Acid
| Molecular Formula | C7H9N3O2 |
|---|---|
| Molecular Weight | 167.07 g/mol |
| LogP | 0.15842 |
| Topological Polar Surface Area | 68.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 167.06947 |
| Heavy Atoms | 12 |
| Complexity | 331.39252 |
Chemical Identifiers
| CAS Number | 160205-15-2 |
|---|---|
| SMILES | CC1=NN=C2N1C(CC2)C(=O)O |
Product Overview
3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid (CAS 160205-15-2), with molecular formula C7H9N3O2 and molecular weight 167.07 g/mol. IUPAC: 3-methyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole-5-carboxylic acid.
Chemical Property Profile of 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid
Property Insights of 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid
The XLogP value of 0.15842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid. The TPSA of 68.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid. Following Lipinski's Rule of Five, 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid has 1 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 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid?
The CAS number of 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid is 160205-15-2.
What is the molecular formula of 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid?
The molecular formula of 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid is C7H9N3O2.
What is the molecular weight of 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid?
The molecular weight of 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid is 167.07 g/mol.
Where can I buy 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid?
You can request a quote for 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-5H,6H,7H-pyrrolo(2,1-c)(1,2,4)triazole-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.