1-(1H-indazol-4-yl)-3-methylthiourea
TL;DR: 1-(1H-indazol-4-yl)-3-methylthiourea (CAS 685108-63-8) is a chemical compound with molecular formula C9H10N4S and molecular weight 206.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-indazol-4-yl)-3-methylthiourea
Also Known As: 1-(1H-indazol-4-yl)-3-methylthiourea, N-(1H-indazol-4-yl)-N'-methylthiourea, Thiourea, N-1H-indazol-4-yl-N'-methyl-, 1-(1H-indazol-4-yl)-3-methyl-thiourea
| Molecular Formula | C9H10N4S |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 1.4791 |
| Topological Polar Surface Area | 52.74 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.06262 |
| Heavy Atoms | 14 |
| Complexity | 462.53482 |
Chemical Identifiers
| CAS Number | 685108-63-8 |
|---|---|
| SMILES | CNC(=S)NC1=CC=CC2=C1C=NN2 |
Product Overview
1-(1H-indazol-4-yl)-3-methylthiourea (CAS 685108-63-8), with molecular formula C9H10N4S and molecular weight 206.06 g/mol. IUPAC: 1-(1H-indazol-4-yl)-3-methylthiourea.
Chemical Property Profile of 1-(1H-indazol-4-yl)-3-methylthiourea
Property Insights of 1-(1H-indazol-4-yl)-3-methylthiourea
The XLogP value of 1.4791 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1H-indazol-4-yl)-3-methylthiourea. With a topological polar surface area (TPSA) of 52.74 Ų, 1-(1H-indazol-4-yl)-3-methylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1H-indazol-4-yl)-3-methylthiourea has 3 hydrogen bond donor(s) and 2 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-(1H-indazol-4-yl)-3-methylthiourea?
The CAS number of 1-(1H-indazol-4-yl)-3-methylthiourea is 685108-63-8.
What is the molecular formula of 1-(1H-indazol-4-yl)-3-methylthiourea?
The molecular formula of 1-(1H-indazol-4-yl)-3-methylthiourea is C9H10N4S.
What is the molecular weight of 1-(1H-indazol-4-yl)-3-methylthiourea?
The molecular weight of 1-(1H-indazol-4-yl)-3-methylthiourea is 206.06 g/mol.
Where can I buy 1-(1H-indazol-4-yl)-3-methylthiourea?
You can request a quote for 1-(1H-indazol-4-yl)-3-methylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1H-indazol-4-yl)-3-methylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-indazol-4-yl)-3-methylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.