[(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione
TL;DR: [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione (CAS 590351-69-2) is a chemical compound with molecular formula C11H13N5S and molecular weight 247.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-methylpyrazol-3-yl)-3-(pyridin-2-ylmethyl)thiourea
Also Known As: 1-(1-methylpyrazol-3-yl)-3-(pyridin-2-ylmethyl)thiourea, 3-(1-methylpyrazol-3-yl)-1-(pyridin-2-ylmethyl)thiourea, 1-(1-methyl-1H-pyrazol-3-yl)-3-(pyridin-2-ylmethyl)thiourea, N-(1-methyl-1H-pyrazol-3-yl)-N'-(2-pyridinylmethyl)thiourea, [(1-methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione
| Molecular Formula | C11H13N5S |
|---|---|
| Molecular Weight | 247.09 g/mol |
| LogP | 1.3017 |
| Topological Polar Surface Area | 54.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.08917 |
| Heavy Atoms | 17 |
| Complexity | 493.57272 |
Chemical Identifiers
| CAS Number | 590351-69-2 |
|---|---|
| SMILES | CN1C=CC(=N1)NC(=S)NCC2=CC=CC=N2 |
Product Overview
[(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione (CAS 590351-69-2), with molecular formula C11H13N5S and molecular weight 247.09 g/mol. IUPAC: 1-(1-methylpyrazol-3-yl)-3-(pyridin-2-ylmethyl)thiourea.
Chemical Property Profile of [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione
Property Insights of [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione
The XLogP value of 1.3017 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione. With a topological polar surface area (TPSA) of 54.77 Ų, [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione 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-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione?
The CAS number of [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione is 590351-69-2.
What is the molecular formula of [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione?
The molecular formula of [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione is C11H13N5S.
What is the molecular weight of [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione?
The molecular weight of [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione is 247.09 g/mol.
Where can I buy [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione?
You can request a quote for [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione?
Yes, KEHONG BIO provides custom synthesis services for [(1-Methylpyrazol-3-yl)amino][(2-pyridylmethyl)amino]methane-1-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.