IFLab1_001167
TL;DR: IFLab1_001167 (CAS 330201-71-3) is a chemical compound with molecular formula C18H19ClN2O3S and molecular weight 378.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(4-chlorophenoxy)acetyl]amino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: IFLab1_001167, IDI1_009034, F0336-0196, 2-[2-(4-chlorophenoxy)acetamido]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-(2-(4-chlorophenoxy)acetamido)-5-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide
| Molecular Formula | C18H19ClN2O3S |
|---|---|
| Molecular Weight | 378.08 g/mol |
| LogP | 3.6427 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.0805 |
| Heavy Atoms | 25 |
| Complexity | 801.39764 |
Chemical Identifiers
| CAS Number | 330201-71-3 |
|---|---|
| SMILES | CC1CCC2=C(C1)C(=C(S2)NC(=O)COC3=CC=C(C=C3)Cl)C(=O)N |
Product Overview
IFLab1_001167 (CAS 330201-71-3), with molecular formula C18H19ClN2O3S and molecular weight 378.08 g/mol. IUPAC: 2-[[2-(4-chlorophenoxy)acetyl]amino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of IFLab1_001167
Property Insights of IFLab1_001167
The XLogP value of 3.6427 indicates that IFLab1_001167 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.42 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_001167. Following Lipinski's Rule of Five, IFLab1_001167 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 IFLab1_001167?
The CAS number of IFLab1_001167 is 330201-71-3.
What is the molecular formula of IFLab1_001167?
The molecular formula of IFLab1_001167 is C18H19ClN2O3S.
What is the molecular weight of IFLab1_001167?
The molecular weight of IFLab1_001167 is 378.08 g/mol.
Where can I buy IFLab1_001167?
You can request a quote for IFLab1_001167 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_001167?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_001167 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.