1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine
TL;DR: 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine (CAS 851679-30-6) is a chemical compound with molecular formula C10H6ClN5 and molecular weight 231.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(1,2,4-triazol-1-yl)phthalazine
Also Known As: 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine, 1-chloro-4-(1,2,4-triazol-1-yl)phthalazine, 4-chloro-1-(1,2,4-triazol-1-yl)phthalazine, Phthalazine, 1-chloro-4-(1H-1,2,4-triazol-1-yl)-
| Molecular Formula | C10H6ClN5 |
|---|---|
| Molecular Weight | 231.03 g/mol |
| LogP | 1.8639 |
| Topological Polar Surface Area | 56.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.03117 |
| Heavy Atoms | 16 |
| Complexity | 634.75934 |
Chemical Identifiers
| CAS Number | 851679-30-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NN=C2Cl)N3C=NC=N3 |
Product Overview
1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine (CAS 851679-30-6), with molecular formula C10H6ClN5 and molecular weight 231.03 g/mol. IUPAC: 1-chloro-4-(1,2,4-triazol-1-yl)phthalazine.
Chemical Property Profile of 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine
Property Insights of 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine
The XLogP value of 1.8639 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine. With a topological polar surface area (TPSA) of 56.49 Ų, 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine 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-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine?
The CAS number of 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine is 851679-30-6.
What is the molecular formula of 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine?
The molecular formula of 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine is C10H6ClN5.
What is the molecular weight of 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine?
The molecular weight of 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine is 231.03 g/mol.
Where can I buy 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine?
You can request a quote for 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine?
Yes, KEHONG BIO provides custom synthesis services for 1-chloro-4-(1H-1,2,4-triazol-1-yl)Phthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.