C7H7Cl2N5S
TL;DR: C7H7Cl2N5S (CAS 175202-31-0) is a chemical compound with molecular formula C7H7Cl2N5S and molecular weight 262.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4,5-dichloroimidazol-1-yl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione
Also Known As: 5-[(4,5-dichloro-1H-imidazol-1-yl)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol, BUTTPARK 36\04-42, 5-[(4,5-Dichloroimidazol-1-yl)methyl]-4-methyl-1,2,4-trizole-3-thiol, 3-[(4,5-dichloroimidazol-1-yl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione, 3-((4,5-Dichloro-1H-imidazol-1-yl)methyl)-4-methyl-1H-1,2,4-triazole-5(4H)-thione
| Molecular Formula | C7H7Cl2N5S |
|---|---|
| Molecular Weight | 262.98 g/mol |
| LogP | 2.02929 |
| Topological Polar Surface Area | 51.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.97992 |
| Heavy Atoms | 15 |
| Complexity | 539.81323 |
Chemical Identifiers
| CAS Number | 175202-31-0 |
|---|---|
| SMILES | CN1C(=NNC1=S)CN2C=NC(=C2Cl)Cl |
Product Overview
C7H7Cl2N5S (CAS 175202-31-0), with molecular formula C7H7Cl2N5S and molecular weight 262.98 g/mol. IUPAC: 3-[(4,5-dichloroimidazol-1-yl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione.
Chemical Property Profile of C7H7Cl2N5S
Property Insights of C7H7Cl2N5S
The XLogP value of 2.02929 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C7H7Cl2N5S. With a topological polar surface area (TPSA) of 51.43 Ų, C7H7Cl2N5S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C7H7Cl2N5S 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 C7H7Cl2N5S?
The CAS number of C7H7Cl2N5S is 175202-31-0.
What is the molecular formula of C7H7Cl2N5S?
The molecular formula of C7H7Cl2N5S is C7H7Cl2N5S.
What is the molecular weight of C7H7Cl2N5S?
The molecular weight of C7H7Cl2N5S is 262.98 g/mol.
Where can I buy C7H7Cl2N5S?
You can request a quote for C7H7Cl2N5S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C7H7Cl2N5S?
Yes, KEHONG BIO provides custom synthesis services for C7H7Cl2N5S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.