![1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea structure](/static/products/895/895005-81-9.png)
1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea
TL;DR: 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea (CAS 895005-81-9) is a chemical compound with molecular formula C19H23N7O2S2 and molecular weight 445.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea
Also Known As: 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea, ({4-[({[(1-ethyl-3-methylpyrazol-4-yl)methyl]methylamino}thioxomethyl)amino]ph enyl}sulfonyl)pyrimidin-2-ylamine, 4-({[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl](methyl)carbamothioyl}amino)-N-(pyrimidin-2-yl)benzenesulfonamide
| Molecular Formula | C19H23N7O2S2 |
|---|---|
| Molecular Weight | 445.14 g/mol |
| LogP | 2.63102 |
| Topological Polar Surface Area | 105.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 445.13547 |
| Heavy Atoms | 30 |
| Complexity | 1113.5446 |
Chemical Identifiers
| CAS Number | 895005-81-9 |
|---|---|
| SMILES | CCN1C=C(C(=N1)C)CN(C)C(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3 |
Product Overview
1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea (CAS 895005-81-9), with molecular formula C19H23N7O2S2 and molecular weight 445.14 g/mol. IUPAC: 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea.
Chemical Property Profile of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea
Property Insights of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea
The XLogP value of 2.63102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea. The TPSA of 105.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea. Following Lipinski's Rule of Five, 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea has 2 hydrogen bond donor(s) and 6 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-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea?
The CAS number of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea is 895005-81-9.
What is the molecular formula of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea?
The molecular formula of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea is C19H23N7O2S2.
What is the molecular weight of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea?
The molecular weight of 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea is 445.14 g/mol.
Where can I buy 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea?
You can request a quote for 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-methyl-3-[4-(pyrimidin-2-ylsulfamoyl)phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.