N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide
TL;DR: N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide (CAS 309275-85-2) is a chemical compound with molecular formula C14H16N4O3S and molecular weight 320.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide
Also Known As: BAS 01182672, N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide, N-(2,5-dimethoxyphenyl)-N'-[(1-methyl-1H-pyrazol-5-yl)carbonyl]thiourea, N-[(2,5-dimethoxyphenyl)carbamothioyl]-1-methyl-1H-pyrazole-5-carboxamide, 1-(2,5-Dimethoxy-phenyl)-3-(2-methyl-2H-pyrazole-3-carbonyl)-thiourea
| Molecular Formula | C14H16N4O3S |
|---|---|
| Molecular Weight | 320.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.0943 |
| Heavy Atoms | 22 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 309275-85-2 |
|---|---|
| SMILES | CN1C(=CC=N1)C(=O)NC(=S)NC2=C(C=CC(=C2)OC)OC |
| InChIKey | PLKAEFKZZLRAEF-UHFFFAOYSA-N |
Product Overview
N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide (CAS 309275-85-2), with molecular formula C14H16N4O3S and molecular weight 320.09 g/mol. IUPAC: N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide.
Chemical Property Profile of N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide
Property Insights of N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide. Following Lipinski's Rule of Five, N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide 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 N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide?
The CAS number of N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide is 309275-85-2.
What is the molecular formula of N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide?
The molecular formula of N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide is C14H16N4O3S.
What is the molecular weight of N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide?
The molecular weight of N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide is 320.09 g/mol.
Where can I buy N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide?
You can request a quote for N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-methylpyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.