RefChem:825422
TL;DR: RefChem:825422 (CAS 618071-70-8) is a chemical compound with molecular formula C22H22N2O3S and molecular weight 394.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-[(4-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: CBKinase1_001870, CBKinase1_014270, N-(2-furylmethyl)-2-[(4-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, BRD-K04813530-001-01-4, N-(Furan-2-ylmethyl)-2-(4-methylbenzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide
| Molecular Formula | C22H22N2O3S |
|---|---|
| Molecular Weight | 394.14 g/mol |
| LogP | 4.71062 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.1351 |
| Heavy Atoms | 28 |
| Complexity | 987.7208 |
Chemical Identifiers
| CAS Number | 618071-70-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCC4=CC=CO4 |
Product Overview
RefChem:825422 (CAS 618071-70-8), with molecular formula C22H22N2O3S and molecular weight 394.14 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[(4-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of RefChem:825422
Property Insights of RefChem:825422
The XLogP value of 4.71062 indicates that RefChem:825422 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:825422. Following Lipinski's Rule of Five, RefChem:825422 has 2 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:825422?
The CAS number of RefChem:825422 is 618071-70-8.
What is the molecular formula of RefChem:825422?
The molecular formula of RefChem:825422 is C22H22N2O3S.
What is the molecular weight of RefChem:825422?
The molecular weight of RefChem:825422 is 394.14 g/mol.
Where can I buy RefChem:825422?
You can request a quote for RefChem:825422 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:825422?
Yes, KEHONG BIO provides custom synthesis services for RefChem:825422 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.