1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea
TL;DR: 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea (CAS 405067-52-9) is a chemical compound with molecular formula C14H15N3OS and molecular weight 273.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea
Also Known As: 1-(4-methoxyphenyl)-3-[(pyridin-3-yl)methyl]thiourea, 1-(4-methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea, BAS 03051746, BIM-0042254.P001, 1-(4-methoxyphenyl)-3-(3-pyridylmethyl)thiourea
| Molecular Formula | C14H15N3OS |
|---|---|
| Molecular Weight | 273.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 78.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 273.0936 |
| Heavy Atoms | 19 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 405067-52-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=S)NCC2=CN=CC=C2 |
| InChIKey | QPSIXHFJPXAXBU-UHFFFAOYSA-N |
Product Overview
1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea (CAS 405067-52-9), with molecular formula C14H15N3OS and molecular weight 273.09 g/mol. IUPAC: 1-(4-methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea.
Chemical Property Profile of 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea
Property Insights of 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea. The TPSA of 78.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea. Following Lipinski's Rule of Five, 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)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 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea?
The CAS number of 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea is 405067-52-9.
What is the molecular formula of 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea?
The molecular formula of 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea is C14H15N3OS.
What is the molecular weight of 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea?
The molecular weight of 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea is 273.09 g/mol.
Where can I buy 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea?
You can request a quote for 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methoxyphenyl)-3-(pyridin-3-ylmethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.