AY 30068
TL;DR: AY 30068 (CAS 106464-24-8) is a chemical compound with molecular formula C21H27NO2 and molecular weight 325.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(1S,4R)-8-ethyl-4-prop-2-enyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetate
Also Known As: AY 30068, AY-30,068, 1H-Carbazole-1-acetic acid, 1,8-diethyl-2,3,4,9-tetrahydro-4-(2-propenyl)-, cis-, ethyl 2-[(1S,4R)-8-ethyl-4-prop-2-enyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetate, 4-(2-Propenyl)-1,8-diethyl-2,3,4,9-tetrahydro-1H-carbazoleacetic acid
| Molecular Formula | C21H27NO2 |
|---|---|
| Molecular Weight | 325.20 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 42.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 325.2042 |
| Heavy Atoms | 24 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 106464-24-8 |
|---|---|
| SMILES | CCC1=C2C(=CC=C1)C3=C(N2)[C@@H](CC[C@@H]3CC=C)CC(=O)OCC |
| InChIKey | CCBNJIRTSXFNHY-HOTGVXAUSA-N |
Product Overview
AY 30068 (CAS 106464-24-8), with molecular formula C21H27NO2 and molecular weight 325.20 g/mol. IUPAC: ethyl 2-[(1S,4R)-8-ethyl-4-prop-2-enyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetate.
Chemical Property Profile of AY 30068
Property Insights of AY 30068
The XLogP value of 5.0 indicates that AY 30068 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.1 Ų, AY 30068 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AY 30068 has 1 hydrogen bond donor(s) and 2 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 AY 30068?
The CAS number of AY 30068 is 106464-24-8.
What is the molecular formula of AY 30068?
The molecular formula of AY 30068 is C21H27NO2.
What is the molecular weight of AY 30068?
The molecular weight of AY 30068 is 325.20 g/mol.
Where can I buy AY 30068?
You can request a quote for AY 30068 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AY 30068?
Yes, KEHONG BIO provides custom synthesis services for AY 30068 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.