Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide
TL;DR: Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide (CAS 13153-02-1) is a chemical compound with molecular formula C13H13N3O2S2 and molecular weight 307.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzenesulfonamido)-3-phenylthiourea
Also Known As: 1-benzenesulfonamido-3-phenylthiourea, 1-(benzenesulfonamido)-3-phenylthiourea, 1-(benzenesulfonamido)-3-phenyl-thiourea, 1-(Phenylsulfonyl)-4-phenylthiosemicarbazide, 4-PHENYL-1-(PHENYLSULFONYL)-3-THIOSEMICARBAZIDE
| Molecular Formula | C13H13N3O2S2 |
|---|---|
| Molecular Weight | 307.04 g/mol |
| LogP | 1.8665 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.04492 |
| Heavy Atoms | 20 |
| Complexity | 673.27716 |
Chemical Identifiers
| CAS Number | 13153-02-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NNS(=O)(=O)C2=CC=CC=C2 |
Product Overview
Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide (CAS 13153-02-1), with molecular formula C13H13N3O2S2 and molecular weight 307.04 g/mol. IUPAC: 1-(benzenesulfonamido)-3-phenylthiourea.
Chemical Property Profile of Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide
Property Insights of Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide
The XLogP value of 1.8665 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide. Following Lipinski's Rule of Five, Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide 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 Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide?
The CAS number of Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide is 13153-02-1.
What is the molecular formula of Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide?
The molecular formula of Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide is C13H13N3O2S2.
What is the molecular weight of Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide?
The molecular weight of Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide is 307.04 g/mol.
Where can I buy Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide?
You can request a quote for Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, 2-((phenylamino)thioxomethyl)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.