RefChem:296771
TL;DR: RefChem:296771 (CAS 69099-50-9) is a chemical compound with molecular formula C24H26N4OS and molecular weight 418.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-ethylpyrrolidin-2-yl)methyl]-1-phenyl-4H-thiochromeno[3,4-d]pyrazole-3-carboxamide
Also Known As: 4H-(1)Benzothiopyrano(4,3-c)pyrazole-3-carboxamide, N-((1-ethyl-2-pyrrolidinyl)methyl)-1-phenyl-, N-[(1-ethylpyrrolidin-2-yl)methyl]-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide, N-[(1-Ethylpyrrolidin-2-yl)methyl]-1-phenyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboximidic acid, N-[(1-ethylpyrrolidin-2-yl)methyl]-1-phenyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide, N-[(1-Ethylpyrrolidin-2-yl)methyl]-1-phenyl-4H-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
| Molecular Formula | C24H26N4OS |
|---|---|
| Molecular Weight | 418.18 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 75.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.18274 |
| Heavy Atoms | 30 |
| Complexity | 598.0 |
Chemical Identifiers
| CAS Number | 69099-50-9 |
|---|---|
| SMILES | CCN1CCCC1CNC(=O)C2=NN(C3=C2CSC4=CC=CC=C43)C5=CC=CC=C5 |
| InChIKey | QXFXLKUYIMNTSW-UHFFFAOYSA-N |
Product Overview
RefChem:296771 (CAS 69099-50-9), with molecular formula C24H26N4OS and molecular weight 418.18 g/mol. IUPAC: N-[(1-ethylpyrrolidin-2-yl)methyl]-1-phenyl-4H-thiochromeno[3,4-d]pyrazole-3-carboxamide.
Chemical Property Profile of RefChem:296771
Property Insights of RefChem:296771
The XLogP value of 4.2 indicates that RefChem:296771 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:296771. Following Lipinski's Rule of Five, RefChem:296771 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
Frequently Asked Questions
What is the CAS number of RefChem:296771?
The CAS number of RefChem:296771 is 69099-50-9.
What is the molecular formula of RefChem:296771?
The molecular formula of RefChem:296771 is C24H26N4OS.
What is the molecular weight of RefChem:296771?
The molecular weight of RefChem:296771 is 418.18 g/mol.
Where can I buy RefChem:296771?
You can request a quote for RefChem:296771 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:296771?
Yes, KEHONG BIO provides custom synthesis services for RefChem:296771 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.