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1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea
TL;DR: 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea (CAS 701276-22-4) is a chemical compound with molecular formula C14H13Cl2N3O2S2 and molecular weight 388.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea
Also Known As: 1-benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea, N-benzyl-2-[(2,5-dichlorophenyl)sulfonyl]hydrazinecarbothioamide, 1-[(2,5-dichlorophenyl)sulfonyl]-2-{[benzylamino]thioxomethyl}hydrazine
| Molecular Formula | C14H13Cl2N3O2S2 |
|---|---|
| Molecular Weight | 388.98 g/mol |
| LogP | 2.851 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.98264 |
| Heavy Atoms | 23 |
| Complexity | 798.9246 |
Chemical Identifiers
| CAS Number | 701276-22-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=S)NNS(=O)(=O)C2=C(C=CC(=C2)Cl)Cl |
Product Overview
1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea (CAS 701276-22-4), with molecular formula C14H13Cl2N3O2S2 and molecular weight 388.98 g/mol. IUPAC: 1-benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea.
Chemical Property Profile of 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea
Property Insights of 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea
The XLogP value of 2.851 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea. Following Lipinski's Rule of Five, 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea has 3 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 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea?
The CAS number of 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea is 701276-22-4.
What is the molecular formula of 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea?
The molecular formula of 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea is C14H13Cl2N3O2S2.
What is the molecular weight of 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea?
The molecular weight of 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea is 388.98 g/mol.
Where can I buy 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea?
You can request a quote for 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3-[(2,5-dichlorophenyl)sulfonylamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.