[[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea
TL;DR: [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea (CAS 5445-15-8) is a chemical compound with molecular formula C10H12N6S2 and molecular weight 280.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[3-[(carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea
Also Known As: [[3-[(carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea|2,2'-(1,3-Phenylenedimethanylylidene)di(hydrazine-1-carboximidothioic acid)
| Molecular Formula | C10H12N6S2 |
|---|---|
| Molecular Weight | 280.06 g/mol |
| LogP | 0.0208 |
| Topological Polar Surface Area | 100.82 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.0565 |
| Heavy Atoms | 18 |
| Complexity | 455.6462 |
Chemical Identifiers
| CAS Number | 5445-15-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C=NNC(=S)N)C=NNC(=S)N |
Product Overview
[[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea (CAS 5445-15-8), with molecular formula C10H12N6S2 and molecular weight 280.06 g/mol. IUPAC: [[3-[(carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea.
Chemical Property Profile of [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea
Property Insights of [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea
The XLogP value of 0.0208 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea. The TPSA of 100.82 Ų falls within the moderate polarity range, balancing permeability and solubility for [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea. Following Lipinski's Rule of Five, [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea has 4 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 [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea?
The CAS number of [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea is 5445-15-8.
What is the molecular formula of [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea?
The molecular formula of [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea is C10H12N6S2.
What is the molecular weight of [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea?
The molecular weight of [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea is 280.06 g/mol.
Where can I buy [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea?
You can request a quote for [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [[3-[(Carbamothioylhydrazinylidene)methyl]phenyl]methylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.