N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine
TL;DR: N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine (CAS 347380-34-1) is a chemical compound with molecular formula C15H15N5 and molecular weight 265.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-N-(1,2,4-triazol-4-yl)methanimine
Also Known As: BIM-0004713.P001, 1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-N-(1,2,4-triazol-4-yl)methanimine, (E)-1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-N-(1,2,4-triazol-4-yl)methanimine, (E)-N-((2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene)-4H-1,2,4-triazol-4-amine, N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine
| Molecular Formula | C15H15N5 |
|---|---|
| Molecular Weight | 265.13 g/mol |
| LogP | 2.56784 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.13275 |
| Heavy Atoms | 20 |
| Complexity | 723.227 |
Chemical Identifiers
| CAS Number | 347380-34-1 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=CC=C2)C)/C=N/N3C=NN=C3 |
Product Overview
N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine (CAS 347380-34-1), with molecular formula C15H15N5 and molecular weight 265.13 g/mol. IUPAC: (E)-1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-N-(1,2,4-triazol-4-yl)methanimine.
Chemical Property Profile of N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine
Property Insights of N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine
The XLogP value of 2.56784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine. With a topological polar surface area (TPSA) of 48.0 Ų, N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine has 0 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 N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine?
The CAS number of N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine is 347380-34-1.
What is the molecular formula of N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine?
The molecular formula of N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine is C15H15N5.
What is the molecular weight of N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine?
The molecular weight of N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine is 265.13 g/mol.
Where can I buy N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine?
You can request a quote for N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene]-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.