N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide
TL;DR: N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide (CAS 37865-33-1) is a chemical compound with molecular formula C18H15N3S3 and molecular weight 369.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide
Also Known As: N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide, AO-476/42110294, N-phenyl-3,5-di(thiophen-2-yl)-4,5-dihydro-1H-pyrazole-1-carbothioamide, 1-N-phenylthiocarbamoyl-3,5-di-(2-thienyl)-2-pyrazoline, 3,5-di-thiophen-2-yl-4,5-dihydro-pyrazole-1-carbothioic acid anilide
| Molecular Formula | C18H15N3S3 |
|---|---|
| Molecular Weight | 369.04 g/mol |
| LogP | 5.3577 |
| Topological Polar Surface Area | 27.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 369.04282 |
| Heavy Atoms | 24 |
| Complexity | 839.04333 |
Chemical Identifiers
| CAS Number | 37865-33-1 |
|---|---|
| SMILES | C1C(N(N=C1C2=CC=CS2)C(=S)NC3=CC=CC=C3)C4=CC=CS4 |
Product Overview
N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide (CAS 37865-33-1), with molecular formula C18H15N3S3 and molecular weight 369.04 g/mol. IUPAC: N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide.
Chemical Property Profile of N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide
Property Insights of N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide
The XLogP value of 5.3577 indicates that N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.63 Ų, N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide?
The CAS number of N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide is 37865-33-1.
What is the molecular formula of N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide?
The molecular formula of N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide is C18H15N3S3.
What is the molecular weight of N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide?
The molecular weight of N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide is 369.04 g/mol.
Where can I buy N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide?
You can request a quote for N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-phenyl-3,5-dithiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.