CBKinase1_011511
TL;DR: CBKinase1_011511 (CAS 717827-74-2) is a chemical compound with molecular formula C19H19ClN4O5S2 and molecular weight 482.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline
Also Known As: CBKinase1_011511, CBKinase1_023911, BRD-K96548686-001-01-7, 5-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline, 5-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-N-(2-furylmethyl)-2-nitro-aniline
| Molecular Formula | C19H19ClN4O5S2 |
|---|---|
| Molecular Weight | 482.05 g/mol |
| LogP | 4.0257 |
| Topological Polar Surface Area | 108.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 482.04855 |
| Heavy Atoms | 31 |
| Complexity | 1171.887 |
Chemical Identifiers
| CAS Number | 717827-74-2 |
|---|---|
| SMILES | C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=CO3)S(=O)(=O)C4=CC=C(S4)Cl |
Product Overview
CBKinase1_011511 (CAS 717827-74-2), with molecular formula C19H19ClN4O5S2 and molecular weight 482.05 g/mol. IUPAC: 5-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)-2-nitroaniline.
Chemical Property Profile of CBKinase1_011511
Property Insights of CBKinase1_011511
The XLogP value of 4.0257 indicates that CBKinase1_011511 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.93 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_011511. Following Lipinski's Rule of Five, CBKinase1_011511 has 1 hydrogen bond donor(s) and 8 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 CBKinase1_011511?
The CAS number of CBKinase1_011511 is 717827-74-2.
What is the molecular formula of CBKinase1_011511?
The molecular formula of CBKinase1_011511 is C19H19ClN4O5S2.
What is the molecular weight of CBKinase1_011511?
The molecular weight of CBKinase1_011511 is 482.05 g/mol.
Where can I buy CBKinase1_011511?
You can request a quote for CBKinase1_011511 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_011511?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_011511 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.