RefChem:296770
TL;DR: RefChem:296770 (CAS 69099-45-2) is a chemical compound with molecular formula C24H25FN4O2S and molecular weight 452.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluoro-N-(3-morpholin-4-ylpropyl)-1-phenyl-4H-thiochromeno[3,4-d]pyrazole-3-carboxamide
Also Known As: 4H-(1)Benzothiopyrano(4,3-c)pyrazole-3-carboxamide, 6-fluoro-N-(3-morpholinopropyl)-1-phenyl-, 6-fluoro-N-(3-morpholin-4-ylpropyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide, 6-Fluoro-N-(3-morpholinopropyl)-1-phenyl-4H-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide, 6-Fluoro-N-[3-(morpholin-4-yl)propyl]-1-phenyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide, 6-fluoro-N-[3-(morpholin-4-yl)propyl]-1-phenyl-1H,4H-thiochromeno[4,3-c]pyrazole-3-carboxamide
| Molecular Formula | C24H25FN4O2S |
|---|---|
| Molecular Weight | 452.17 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 84.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.1682 |
| Heavy Atoms | 32 |
| Complexity | 631.0 |
Chemical Identifiers
| CAS Number | 69099-45-2 |
|---|---|
| SMILES | C1COCCN1CCCNC(=O)C2=NN(C3=C2CSC4=C3C=CC=C4F)C5=CC=CC=C5 |
| InChIKey | FMIRDCZDTVXZJI-UHFFFAOYSA-N |
Product Overview
RefChem:296770 (CAS 69099-45-2), with molecular formula C24H25FN4O2S and molecular weight 452.17 g/mol. IUPAC: 6-fluoro-N-(3-morpholin-4-ylpropyl)-1-phenyl-4H-thiochromeno[3,4-d]pyrazole-3-carboxamide.
Chemical Property Profile of RefChem:296770
Property Insights of RefChem:296770
The XLogP value of 3.4 indicates that RefChem:296770 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:296770. Following Lipinski's Rule of Five, RefChem:296770 has 1 hydrogen bond donor(s) and 6 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:296770?
The CAS number of RefChem:296770 is 69099-45-2.
What is the molecular formula of RefChem:296770?
The molecular formula of RefChem:296770 is C24H25FN4O2S.
What is the molecular weight of RefChem:296770?
The molecular weight of RefChem:296770 is 452.17 g/mol.
Where can I buy RefChem:296770?
You can request a quote for RefChem:296770 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:296770?
Yes, KEHONG BIO provides custom synthesis services for RefChem:296770 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.