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N,N'-Bis[(pyridin-4-yl)methyl]thiourea
TL;DR: N,N'-Bis[(pyridin-4-yl)methyl]thiourea (CAS 6965-00-0) is a chemical compound with molecular formula C13H14N4S and molecular weight 258.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(pyridin-4-ylmethyl)thiourea
Also Known As: 1,3-bis(pyridin-4-ylmethyl)thiourea, N,N'-Bis[(pyridin-4-yl)methyl]thiourea, Thiourea,n,n-bis(4-pyridinylmethyl)-
| Molecular Formula | C13H14N4S |
|---|---|
| Molecular Weight | 258.09 g/mol |
| LogP | 1.6409 |
| Topological Polar Surface Area | 49.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.0939 |
| Heavy Atoms | 18 |
| Complexity | 441.35913 |
Chemical Identifiers
| CAS Number | 6965-00-0 |
|---|---|
| SMILES | C1=CN=CC=C1CNC(=S)NCC2=CC=NC=C2 |
Product Overview
N,N'-Bis[(pyridin-4-yl)methyl]thiourea (CAS 6965-00-0), with molecular formula C13H14N4S and molecular weight 258.09 g/mol. IUPAC: 1,3-bis(pyridin-4-ylmethyl)thiourea.
Chemical Property Profile of N,N'-Bis[(pyridin-4-yl)methyl]thiourea
Property Insights of N,N'-Bis[(pyridin-4-yl)methyl]thiourea
The XLogP value of 1.6409 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-Bis[(pyridin-4-yl)methyl]thiourea. With a topological polar surface area (TPSA) of 49.84 Ų, N,N'-Bis[(pyridin-4-yl)methyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-Bis[(pyridin-4-yl)methyl]thiourea has 2 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 N,N'-Bis[(pyridin-4-yl)methyl]thiourea?
The CAS number of N,N'-Bis[(pyridin-4-yl)methyl]thiourea is 6965-00-0.
What is the molecular formula of N,N'-Bis[(pyridin-4-yl)methyl]thiourea?
The molecular formula of N,N'-Bis[(pyridin-4-yl)methyl]thiourea is C13H14N4S.
What is the molecular weight of N,N'-Bis[(pyridin-4-yl)methyl]thiourea?
The molecular weight of N,N'-Bis[(pyridin-4-yl)methyl]thiourea is 258.09 g/mol.
Where can I buy N,N'-Bis[(pyridin-4-yl)methyl]thiourea?
You can request a quote for N,N'-Bis[(pyridin-4-yl)methyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-Bis[(pyridin-4-yl)methyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for N,N'-Bis[(pyridin-4-yl)methyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.