TH115
TL;DR: TH115 (CAS 893954-48-8) is a chemical compound with molecular formula C20H17F2N3OS and molecular weight 385.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2,4-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4-difluorobenzamide
Also Known As: TH115, F1878-0435, N-[2-(2,4-dimethylphenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]-3,4-difluorobenzamide, N-(2-(2,4-dimethylphenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-3,4-difluorobenzamide, N-[2-(2,4-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4-difluorobenzamide
| Molecular Formula | C20H17F2N3OS |
|---|---|
| Molecular Weight | 385.11 g/mol |
| LogP | 4.76644 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 385.10605 |
| Heavy Atoms | 27 |
| Complexity | 1061.6206 |
Chemical Identifiers
| CAS Number | 893954-48-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C(=C3CSCC3=N2)NC(=O)C4=CC(=C(C=C4)F)F)C |
Product Overview
TH115 (CAS 893954-48-8), with molecular formula C20H17F2N3OS and molecular weight 385.11 g/mol. IUPAC: N-[2-(2,4-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4-difluorobenzamide.
Chemical Property Profile of TH115
Property Insights of TH115
The XLogP value of 4.76644 indicates that TH115 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, TH115 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TH115 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 TH115?
The CAS number of TH115 is 893954-48-8.
What is the molecular formula of TH115?
The molecular formula of TH115 is C20H17F2N3OS.
What is the molecular weight of TH115?
The molecular weight of TH115 is 385.11 g/mol.
Where can I buy TH115?
You can request a quote for TH115 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TH115?
Yes, KEHONG BIO provides custom synthesis services for TH115 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.