2-Chlor-5-jod-anilin
TL;DR: 2-Chlor-5-jod-anilin (CAS 166042-09-7) is a chemical compound with molecular formula C20H19N5O and molecular weight 345.15897 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-7-propan-2-yl-3-(2H-tetrazol-5-yl)cyclohepta[b]pyrrol-2-one
Also Known As: 2-Chlor-5-jod-anilin, (4-Bromophenyl)-2-pyridyl ketone, 1-Benzyl-7-isopropyl-3-(5-tetrazolyl)-1-azaazulen-2-one, Cyclohepta(b)pyrrol-2(1H)-one, 7-(1-methylethyl)-1-(phenylmethyl)-3-(1H-tetrazol-5-yl)-, 1-benzyl-7-propan-2-yl-3-(2H-tetrazol-5-yl)cyclohepta[b]pyrrol-2-one
Technical Specifications
| Molecular Formula | C20H19N5O |
| Molecular Weight | 345.15897 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 74.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.15897 Da |
| Heavy Atoms | 26 |
| Complexity | 697.0 |
| SMILES | CC(C)C1=CC=CC2=C(C(=O)N(C2=C1)CC3=CC=CC=C3)C4=NNN=N4 |
| InChIKey | BWQZSSQCFHRJFT-UHFFFAOYSA-N |
Chemical Property Profile of 2-Chlor-5-jod-anilin
Property Insights of 2-Chlor-5-jod-anilin
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chlor-5-jod-anilin. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chlor-5-jod-anilin. Following Lipinski's Rule of Five, 2-Chlor-5-jod-anilin has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Chlor-5-jod-anilin?
The CAS number of 2-Chlor-5-jod-anilin is 166042-09-7.
What is the molecular formula of 2-Chlor-5-jod-anilin?
The molecular formula of 2-Chlor-5-jod-anilin is C20H19N5O.
What is the molecular weight of 2-Chlor-5-jod-anilin?
The molecular weight of 2-Chlor-5-jod-anilin is 345.15897 g/mol.
Where can I buy 2-Chlor-5-jod-anilin?
You can request a quote for 2-Chlor-5-jod-anilin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Chlor-5-jod-anilin?
Yes, CoreyChem provides custom synthesis services for 2-Chlor-5-jod-anilin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.