2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)-
TL;DR: 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)- (CAS 629616-26-8) is a chemical compound with molecular formula C10H7ClN2S and molecular weight 222.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzylidene-4-chloroimidazole-2-thione
Also Known As: 5-benzylidene-4-chloroimidazole-2-thione, NCI60_030318, 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)-, 5-Benzylidene-4-chloro-1,5-dihydro-2H-imidazole-2-thione
| Molecular Formula | C10H7ClN2S |
|---|---|
| Molecular Weight | 222.00 g/mol |
| LogP | 2.5529 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.00185 |
| Heavy Atoms | 14 |
| Complexity | 423.00797 |
Chemical Identifiers
| CAS Number | 629616-26-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C2C(=NC(=S)N2)Cl |
Product Overview
2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)- (CAS 629616-26-8), with molecular formula C10H7ClN2S and molecular weight 222.00 g/mol. IUPAC: 5-benzylidene-4-chloroimidazole-2-thione.
Chemical Property Profile of 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)-
Property Insights of 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)-
The XLogP value of 2.5529 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)-. With a topological polar surface area (TPSA) of 24.39 Ų, 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)- has 1 hydrogen bond donor(s) and 1 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 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)-?
The CAS number of 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)- is 629616-26-8.
What is the molecular formula of 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)-?
The molecular formula of 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)- is C10H7ClN2S.
What is the molecular weight of 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)-?
The molecular weight of 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)- is 222.00 g/mol.
Where can I buy 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)-?
You can request a quote for 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-Imidazole-2-thione, 4-chloro-1,5-dihydro-5-(phenylmethylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.