瓜菊酯 I
TL;DR: 瓜菊酯 I (CAS 25402-06-6) is a chemical compound with molecular formula C19H27N3O2 and molecular weight 329.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
瓜菊酯 I
N-[1-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]piperidin-4-yl]acetamide
Also Known As: 5-22-12-00094 (Beilstein Handbook Reference), Acetamide, N-(1-(2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl)-4-piperidinyl)-, 3-(2-(4-Acetamidopiperid-1-yl)ethyl)-5-methoxy-2-methylindole, N-(1-(2-(5-Methoxy-2-methyl-1H-indol-3-yl)ethyl)-4-piperidinyl)acetamide, n-{1-[2-(5-methoxy-2-methyl-1h-indol-3-yl)ethyl]piperidin-4-yl}acetamide
| Molecular Formula | C19H27N3O2 |
|---|---|
| Molecular Weight | 329.21 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 57.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.21033 |
| Heavy Atoms | 24 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 25402-06-6 |
|---|---|
| SMILES | CC1=C(C2=C(N1)C=CC(=C2)OC)CCN3CCC(CC3)NC(=O)C |
| InChIKey | GLYFMAIZDDRWSD-UHFFFAOYSA-N |
Product Overview
瓜菊酯 I (CAS 25402-06-6), with molecular formula C19H27N3O2 and molecular weight 329.21 g/mol. IUPAC: N-[1-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]piperidin-4-yl]acetamide.
Chemical Property Profile of 瓜菊酯 I
Property Insights of 瓜菊酯 I
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 瓜菊酯 I. With a topological polar surface area (TPSA) of 57.4 Ų, 瓜菊酯 I exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 瓜菊酯 I has 2 hydrogen bond donor(s) and 3 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 瓜菊酯 I?
The CAS number of 瓜菊酯 I is 25402-06-6.
What is the molecular formula of 瓜菊酯 I?
The molecular formula of 瓜菊酯 I is C19H27N3O2.
What is the molecular weight of 瓜菊酯 I?
The molecular weight of 瓜菊酯 I is 329.21 g/mol.
Where can I buy 瓜菊酯 I?
You can request a quote for 瓜菊酯 I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 瓜菊酯 I?
Yes, KEHONG BIO provides custom synthesis services for 瓜菊酯 I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.