1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea
TL;DR: 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea (CAS 879565-63-6) is a chemical compound with molecular formula C16H19N3O3S and molecular weight 333.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea
Also Known As: 1-(pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea, N-(3-pyridinylmethyl)-N'-(3,4,5-trimethoxyphenyl)thiourea, N-(3-PYRIDYLMETHYL)-N'-(3,4,5-TRIMETHOXYPHENYL)THIOUREA, [(3-pyridylmethyl)amino][(3,4,5-trimethoxyphenyl)amino]methane-1-thione
| Molecular Formula | C16H19N3O3S |
|---|---|
| Molecular Weight | 333.11 g/mol |
| LogP | 2.594 |
| Topological Polar Surface Area | 64.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.11472 |
| Heavy Atoms | 23 |
| Complexity | 639.87006 |
Chemical Identifiers
| CAS Number | 879565-63-6 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)NC(=S)NCC2=CN=CC=C2 |
Product Overview
1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea (CAS 879565-63-6), with molecular formula C16H19N3O3S and molecular weight 333.11 g/mol. IUPAC: 1-(pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea.
Chemical Property Profile of 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea
Property Insights of 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea
The XLogP value of 2.594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea. The TPSA of 64.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea. Following Lipinski's Rule of Five, 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea has 2 hydrogen bond donor(s) and 5 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-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea?
The CAS number of 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea is 879565-63-6.
What is the molecular formula of 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea?
The molecular formula of 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea is C16H19N3O3S.
What is the molecular weight of 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea?
The molecular weight of 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea is 333.11 g/mol.
Where can I buy 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea?
You can request a quote for 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(Pyridin-3-ylmethyl)-3-(3,4,5-trimethoxyphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.