EGFR-IN-105
TL;DR: EGFR-IN-105 (CAS 831244-98-5) is a chemical compound with molecular formula C20H30N4OS and molecular weight 374.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methylpiperazin-1-yl)acetamide
Also Known As: EGFR-IN-105, CBKinase1_012019, CBKinase1_024419, BRD-A53755802-001-01-0, N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-2-(4-methyl-1-piperazinyl)acetamide
| Molecular Formula | C20H30N4OS |
|---|---|
| Molecular Weight | 374.21 g/mol |
| LogP | 2.95668 |
| Topological Polar Surface Area | 59.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.21402 |
| Heavy Atoms | 26 |
| Complexity | 704.619 |
Chemical Identifiers
| CAS Number | 831244-98-5 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)CN3CCN(CC3)C |
Product Overview
EGFR-IN-105 (CAS 831244-98-5), with molecular formula C20H30N4OS and molecular weight 374.21 g/mol. IUPAC: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methylpiperazin-1-yl)acetamide.
Chemical Property Profile of EGFR-IN-105
Property Insights of EGFR-IN-105
The XLogP value of 2.95668 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EGFR-IN-105. With a topological polar surface area (TPSA) of 59.37 Ų, EGFR-IN-105 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EGFR-IN-105 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 EGFR-IN-105?
The CAS number of EGFR-IN-105 is 831244-98-5.
What is the molecular formula of EGFR-IN-105?
The molecular formula of EGFR-IN-105 is C20H30N4OS.
What is the molecular weight of EGFR-IN-105?
The molecular weight of EGFR-IN-105 is 374.21 g/mol.
Where can I buy EGFR-IN-105?
You can request a quote for EGFR-IN-105 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EGFR-IN-105?
Yes, KEHONG BIO provides custom synthesis services for EGFR-IN-105 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.