IFLab1_001104
TL;DR: IFLab1_001104 (CAS 330190-36-8) is a chemical compound with molecular formula C19H22N2O4S and molecular weight 374.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,4-dimethoxybenzoyl)amino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: IFLab1_001104, IDI1_008971, AB00667251-01, 2-(3,4-dimethoxybenzamido)-5-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide, F0325-0266
| Molecular Formula | C19H22N2O4S |
|---|---|
| Molecular Weight | 374.13 g/mol |
| LogP | 3.2413 |
| Topological Polar Surface Area | 90.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.13004 |
| Heavy Atoms | 26 |
| Complexity | 859.4643 |
Chemical Identifiers
| CAS Number | 330190-36-8 |
|---|---|
| SMILES | CC1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=C(C=C3)OC)OC)C(=O)N |
Product Overview
IFLab1_001104 (CAS 330190-36-8), with molecular formula C19H22N2O4S and molecular weight 374.13 g/mol. IUPAC: 2-[(3,4-dimethoxybenzoyl)amino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of IFLab1_001104
Property Insights of IFLab1_001104
The XLogP value of 3.2413 indicates that IFLab1_001104 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.65 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_001104. Following Lipinski's Rule of Five, IFLab1_001104 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 IFLab1_001104?
The CAS number of IFLab1_001104 is 330190-36-8.
What is the molecular formula of IFLab1_001104?
The molecular formula of IFLab1_001104 is C19H22N2O4S.
What is the molecular weight of IFLab1_001104?
The molecular weight of IFLab1_001104 is 374.13 g/mol.
Where can I buy IFLab1_001104?
You can request a quote for IFLab1_001104 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_001104?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_001104 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.