1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea structure

1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea

TL;DR: 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea (CAS 306954-92-7) is a chemical compound with molecular formula C17H17N5OS2 and molecular weight 371.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

1-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea

Also Known As: AB00100355-01, 1-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea, 2-(1-methylbenzimidazol-2-ylthio)-N-{[(phenylamino)thioxomethyl]amino}acetamid e, 2-(2-((1-methyl-1H-benzo[d]imidazol-2-yl)thio)acetyl)-N-phenylhydrazinecarbothioamide, 2-{[(1-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl}-N-phenylhydrazinecarbothioamide

CAS: 306954-92-7
Molecular Formula C17H17N5OS2
Molecular Weight 371.09 g/mol
LogP 2.6832
Topological Polar Surface Area 70.98 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 371.08746
Heavy Atoms 25
Complexity 894.4494

Chemical Identifiers

CAS Number 306954-92-7
SMILES CN1C2=CC=CC=C2N=C1SCC(=O)NNC(=S)NC3=CC=CC=C3

Product Overview

1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea (CAS 306954-92-7), with molecular formula C17H17N5OS2 and molecular weight 371.09 g/mol. IUPAC: 1-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea

XLogP
2.6832
TPSA (Topological Polar Surface Area)
70.98
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
25
Complexity
894.4494
Exact Mass
371.08746
Monoisotopic Mass
371.08746
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea

The XLogP value of 2.6832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea. The TPSA of 70.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea. Following Lipinski's Rule of Five, 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea?

The CAS number of 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea is 306954-92-7.

What is the molecular formula of 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea?

The molecular formula of 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea is C17H17N5OS2.

What is the molecular weight of 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea?

The molecular weight of 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea is 371.09 g/mol.

Where can I buy 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea?

You can request a quote for 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea?

Yes, KEHONG BIO provides custom synthesis services for 1-[[2-(1-Methylbenzimidazol-2-yl)sulfanylacetyl]amino]-3-phenylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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