2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide
TL;DR: 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide (CAS 20062-64-0) is a chemical compound with molecular formula C12H13N5S and molecular weight 259.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1-benzylimidazol-2-yl)methylideneamino]thiourea
Also Known As: 5-24-02-00083 (Beilstein Handbook Reference), [(E)-(1-benzylimidazol-2-yl)methylideneamino]thiourea, [(1-benzylimidazol-2-yl)methylideneamino]thiourea, 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide, Hydrazinecarbothioamide, 2-((1-(phenylmethyl)-1H-imidazol-2-yl)methylene)-
| Molecular Formula | C12H13N5S |
|---|---|
| Molecular Weight | 259.09 g/mol |
| LogP | 1.0985 |
| Topological Polar Surface Area | 68.23 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.08917 |
| Heavy Atoms | 18 |
| Complexity | 546.6052 |
Chemical Identifiers
| CAS Number | 20062-64-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C=CN=C2C=NNC(=S)N |
Product Overview
2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide (CAS 20062-64-0), with molecular formula C12H13N5S and molecular weight 259.09 g/mol. IUPAC: [(1-benzylimidazol-2-yl)methylideneamino]thiourea.
Chemical Property Profile of 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide
Property Insights of 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide
The XLogP value of 1.0985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide. The TPSA of 68.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide has 2 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 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide?
The CAS number of 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide is 20062-64-0.
What is the molecular formula of 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide?
The molecular formula of 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide is C12H13N5S.
What is the molecular weight of 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide?
The molecular weight of 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide is 259.09 g/mol.
Where can I buy 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide?
You can request a quote for 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((1-(Phenylmethyl)-1H-imidazol-2-yl)methylene)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.