CBKinase1_000528
TL;DR: CBKinase1_000528 (CAS 329935-31-1) is a chemical compound with molecular formula C23H24N2O4S and molecular weight 424.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(4-ethoxyphenyl)carbamoyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]furan-2-carboxamide
Also Known As: CBKinase1_000528, CBKinase1_012928, BAS 00486759, BRD-K98476526-001-01-3, N-[3-[(4-ethoxyphenyl)carbamoyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]furan-2-carboxamide
| Molecular Formula | C23H24N2O4S |
|---|---|
| Molecular Weight | 424.15 g/mol |
| LogP | 5.5133 |
| Topological Polar Surface Area | 80.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.1457 |
| Heavy Atoms | 30 |
| Complexity | 1022.41284 |
Chemical Identifiers
| CAS Number | 329935-31-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCCCC3)NC(=O)C4=CC=CO4 |
Product Overview
CBKinase1_000528 (CAS 329935-31-1), with molecular formula C23H24N2O4S and molecular weight 424.15 g/mol. IUPAC: N-[3-[(4-ethoxyphenyl)carbamoyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]furan-2-carboxamide.
Chemical Property Profile of CBKinase1_000528
Property Insights of CBKinase1_000528
The XLogP value of 5.5133 indicates that CBKinase1_000528 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.57 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_000528. Following Lipinski's Rule of Five, CBKinase1_000528 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_000528?
The CAS number of CBKinase1_000528 is 329935-31-1.
What is the molecular formula of CBKinase1_000528?
The molecular formula of CBKinase1_000528 is C23H24N2O4S.
What is the molecular weight of CBKinase1_000528?
The molecular weight of CBKinase1_000528 is 424.15 g/mol.
Where can I buy CBKinase1_000528?
You can request a quote for CBKinase1_000528 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_000528?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_000528 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.