![1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea structure](/static/products/1005/1005555-00-9.webp)
1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea
TL;DR: 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea (CAS 1005555-00-9) is a chemical compound with molecular formula C20H26N6S and molecular weight 382.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea
Also Known As: 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea, 1-methyl-3-[1-(2-methylbenzyl)-1H-pyrazol-4-yl]-1-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]thiourea, N-METHYL-N'-[1-(2-METHYLBENZYL)-1H-PYRAZOL-4-YL]-N-[(1,3,5-TRIMETHYL-1H-PYRAZOL-4-YL)METHYL]THIOUREA
| Molecular Formula | C20H26N6S |
|---|---|
| Molecular Weight | 382.19 g/mol |
| LogP | 3.41896 |
| Topological Polar Surface Area | 50.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.19397 |
| Heavy Atoms | 27 |
| Complexity | 955.2902 |
Chemical Identifiers
| CAS Number | 1005555-00-9 |
|---|---|
| SMILES | CC1=CC=CC=C1CN2C=C(C=N2)NC(=S)N(C)CC3=C(N(N=C3C)C)C |
Product Overview
1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea (CAS 1005555-00-9), with molecular formula C20H26N6S and molecular weight 382.19 g/mol. IUPAC: 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea.
Chemical Property Profile of 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea
Property Insights of 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea
The XLogP value of 3.41896 indicates that 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.91 Ų, 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea has 1 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-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea?
The CAS number of 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea is 1005555-00-9.
What is the molecular formula of 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea?
The molecular formula of 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea is C20H26N6S.
What is the molecular weight of 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea?
The molecular weight of 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea is 382.19 g/mol.
Where can I buy 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea?
You can request a quote for 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.