ChemDiv3_005767
TL;DR: ChemDiv3_005767 (CAS 515149-04-9) is a chemical compound with molecular formula C17H17BrN4O4S and molecular weight 452.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-bromopyrazol-1-yl)methyl]-N-[4-(ethylsulfamoyl)phenyl]furan-2-carboxamide
Also Known As: ChemDiv3_005767, IDI1_023677, BRD-K29466586-001-01-5, 5-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-{4-[(ethylamino)sulfonyl]phenyl}-2-furamide, 5-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-[4-(ethylsulfamoyl)phenyl]furan-2-carboxamide
| Molecular Formula | C17H17BrN4O4S |
|---|---|
| Molecular Weight | 452.02 g/mol |
| LogP | 2.8374 |
| Topological Polar Surface Area | 106.23 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.01538 |
| Heavy Atoms | 27 |
| Complexity | 1041.0852 |
Chemical Identifiers
| CAS Number | 515149-04-9 |
|---|---|
| SMILES | CCNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)Br |
Product Overview
ChemDiv3_005767 (CAS 515149-04-9), with molecular formula C17H17BrN4O4S and molecular weight 452.02 g/mol. IUPAC: 5-[(4-bromopyrazol-1-yl)methyl]-N-[4-(ethylsulfamoyl)phenyl]furan-2-carboxamide.
Chemical Property Profile of ChemDiv3_005767
Property Insights of ChemDiv3_005767
The XLogP value of 2.8374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_005767. The TPSA of 106.23 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_005767. Following Lipinski's Rule of Five, ChemDiv3_005767 has 2 hydrogen bond donor(s) and 5 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 ChemDiv3_005767?
The CAS number of ChemDiv3_005767 is 515149-04-9.
What is the molecular formula of ChemDiv3_005767?
The molecular formula of ChemDiv3_005767 is C17H17BrN4O4S.
What is the molecular weight of ChemDiv3_005767?
The molecular weight of ChemDiv3_005767 is 452.02 g/mol.
Where can I buy ChemDiv3_005767?
You can request a quote for ChemDiv3_005767 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_005767?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_005767 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.