3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide
TL;DR: 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide (CAS 153332-16-2) is a chemical compound with molecular formula C18H19N3O2S and molecular weight 341.1198 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide
Also Known As: 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide, BB 0218904, 3,5-bis(4-methoxyphenyl)-3,4-dihydropyrazole-2-carbothioamide, 3,5-bis(4-methoxyphenyl)-4,5-dihydropyrazole-1-carbothioamide, (3,5-bis(4-methoxyphenyl)-4,5-dihydro-1h-pyrazole-1-carbothioamide)
Technical Specifications
| Molecular Formula | C18H19N3O2S |
| Molecular Weight | 341.1198 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 92.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.1198 Da |
| Heavy Atoms | 24 |
| Complexity | 469.0 |
| SMILES | COC1=CC=C(C=C1)C2CC(=NN2C(=S)N)C3=CC=C(C=C3)OC |
| InChIKey | MIBFCMZXSTZEII-UHFFFAOYSA-N |
Chemical Property Profile of 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide
Property Insights of 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide. Following Lipinski's Rule of Five, 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide?
The CAS number of 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide is 153332-16-2.
What is the molecular formula of 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide?
The molecular formula of 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide is C18H19N3O2S.
What is the molecular weight of 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide?
The molecular weight of 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide is 341.1198 g/mol.
Where can I buy 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide?
You can request a quote for 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide?
Yes, CoreyChem provides custom synthesis services for 3,5-Bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.