4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine structure

4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine

TL;DR: 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine (CAS 338975-32-9) is a chemical compound with molecular formula C17H15N3S2 and molecular weight 325.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

4-phenylsulfanyl-5-(phenylsulfanylmethyl)pyrimidin-2-amine

Also Known As: 4-(phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine, 4-phenylsulfanyl-5-(phenylsulfanylmethyl)pyrimidin-2-amine, 4-(phenylsulfanyl)-5-[(phenylsulfanyl)methyl]pyrimidin-2-amine, 9B-056, 4-(Phenylsulfanyl)-5-(phenylsulfanyl)methyl-2-pyrimidinamine

CAS: 338975-32-9
Molecular Formula C17H15N3S2
Molecular Weight 325.07 g/mol
LogP 4.5023
Topological Polar Surface Area 51.8 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 5
Exact Mass 325.07074
Heavy Atoms 22
Complexity 733.4026

Chemical Identifiers

CAS Number 338975-32-9
SMILES C1=CC=C(C=C1)SCC2=CN=C(N=C2SC3=CC=CC=C3)N

Product Overview

4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine (CAS 338975-32-9), with molecular formula C17H15N3S2 and molecular weight 325.07 g/mol. IUPAC: 4-phenylsulfanyl-5-(phenylsulfanylmethyl)pyrimidin-2-amine.

🧪
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 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine

XLogP
4.5023
TPSA (Topological Polar Surface Area)
51.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
5
Heavy Atoms
22
Complexity
733.4026
Exact Mass
325.07074
Monoisotopic Mass
325.07074
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 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine

The XLogP value of 4.5023 indicates that 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine has 1 hydrogen bond donor(s) and 5 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 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine?

The CAS number of 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine is 338975-32-9.

What is the molecular formula of 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine?

The molecular formula of 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine is C17H15N3S2.

What is the molecular weight of 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine?

The molecular weight of 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine is 325.07 g/mol.

Where can I buy 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine?

You can request a quote for 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine?

Yes, KEHONG BIO provides custom synthesis services for 4-(Phenylsulfanyl)-5-[(phenylsulfanyl)methyl]-2-pyrimidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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