![1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea structure](/static/products/107/107057-55-6.webp)
1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea
TL;DR: 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea (CAS 107057-55-6) is a chemical compound with molecular formula C14H15N3S and molecular weight 257.09866 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea
Also Known As: 1-methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea, 1-methyl-3-(4-(pyridin-4-ylmethyl)phenyl)thiourea, 1-Methyl-3-(4-pyridin-4-ylmethyl-phenyl)-thiourea
Technical Specifications
| Molecular Formula | C14H15N3S |
| Molecular Weight | 257.09866 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 69.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.09866 Da |
| Heavy Atoms | 18 |
| Complexity | 256.0 |
| SMILES | CNC(=S)NC1=CC=C(C=C1)CC2=CC=NC=C2 |
| InChIKey | RLMVWMMBYOFXIV-UHFFFAOYSA-N |
Chemical Property Profile of 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea
Property Insights of 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea. The TPSA of 69.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea. Following Lipinski's Rule of Five, 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea?
The CAS number of 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea is 107057-55-6.
What is the molecular formula of 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea?
The molecular formula of 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea is C14H15N3S.
What is the molecular weight of 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea?
The molecular weight of 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea is 257.09866 g/mol.
Where can I buy 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea?
You can request a quote for 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea?
Yes, CoreyChem provides custom synthesis services for 1-Methyl-3-[4-(pyridin-4-ylmethyl)phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.