IFLab1_005674
TL;DR: IFLab1_005674 (CAS 622800-25-3) is a chemical compound with molecular formula C23H27N3O2S and molecular weight 409.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4,5-dimethyl-3-[(4-methylpiperazin-1-yl)-phenylmethyl]thiophen-2-yl]furan-2-carboxamide
Also Known As: IFLab1_005674, IDI1_011077, F1477-0282, N-{4,5-DIMETHYL-3-[(4-METHYLPIPERAZIN-1-YL)(PHENYL)METHYL]THIOPHEN-2-YL}FURAN-2-CARBOXAMIDE, N-[4,5-dimethyl-3-[(4-methylpiperazin-1-yl)-phenylmethyl]thiophen-2-yl]furan-2-carboxamide
| Molecular Formula | C23H27N3O2S |
|---|---|
| Molecular Weight | 409.18 g/mol |
| LogP | 4.54704 |
| Topological Polar Surface Area | 48.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.1824 |
| Heavy Atoms | 29 |
| Complexity | 957.6867 |
Chemical Identifiers
| CAS Number | 622800-25-3 |
|---|---|
| SMILES | CC1=C(SC(=C1C(C2=CC=CC=C2)N3CCN(CC3)C)NC(=O)C4=CC=CO4)C |
Product Overview
IFLab1_005674 (CAS 622800-25-3), with molecular formula C23H27N3O2S and molecular weight 409.18 g/mol. IUPAC: N-[4,5-dimethyl-3-[(4-methylpiperazin-1-yl)-phenylmethyl]thiophen-2-yl]furan-2-carboxamide.
Chemical Property Profile of IFLab1_005674
Property Insights of IFLab1_005674
The XLogP value of 4.54704 indicates that IFLab1_005674 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.72 Ų, IFLab1_005674 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, IFLab1_005674 has 1 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_005674?
The CAS number of IFLab1_005674 is 622800-25-3.
What is the molecular formula of IFLab1_005674?
The molecular formula of IFLab1_005674 is C23H27N3O2S.
What is the molecular weight of IFLab1_005674?
The molecular weight of IFLab1_005674 is 409.18 g/mol.
Where can I buy IFLab1_005674?
You can request a quote for IFLab1_005674 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_005674?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_005674 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.