Polyandrocarpamide B
TL;DR: Polyandrocarpamide B (CAS 129369-42-2) is a chemical compound with molecular formula C18H15IN2O3 and molecular weight 434.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-hydroxy-3-iodophenyl)ethyl]-2-(1H-indol-3-yl)-2-oxoacetamide
Also Known As: Polyandrocarpamide B, 1H-Indole-3-acetamide, N-(2-(4-hydroxy-3-iodophenyl)ethyl)-alpha-oxo-, N-[2-(4-hydroxy-3-iodophenyl)ethyl]-2-(1H-indol-3-yl)-2-oxoacetamide, N-[2-(4-hydroxy-3-iodo-phenyl)ethyl]-2-(1H-indol-3-yl)-2-oxo-acetamide, RefChem:175133
| Molecular Formula | C18H15IN2O3 |
|---|---|
| Molecular Weight | 434.01 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 82.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 434.01273 |
| Heavy Atoms | 24 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 129369-42-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)C(=O)C(=O)NCCC3=CC(=C(C=C3)O)I |
| InChIKey | LYSQOZZYHKCETK-UHFFFAOYSA-N |
Product Overview
Polyandrocarpamide B (CAS 129369-42-2), with molecular formula C18H15IN2O3 and molecular weight 434.01 g/mol. IUPAC: N-[2-(4-hydroxy-3-iodophenyl)ethyl]-2-(1H-indol-3-yl)-2-oxoacetamide.
Chemical Property Profile of Polyandrocarpamide B
Property Insights of Polyandrocarpamide B
The XLogP value of 3.5 indicates that Polyandrocarpamide B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Polyandrocarpamide B. Following Lipinski's Rule of Five, Polyandrocarpamide B has 3 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 Polyandrocarpamide B?
The CAS number of Polyandrocarpamide B is 129369-42-2.
What is the molecular formula of Polyandrocarpamide B?
The molecular formula of Polyandrocarpamide B is C18H15IN2O3.
What is the molecular weight of Polyandrocarpamide B?
The molecular weight of Polyandrocarpamide B is 434.01 g/mol.
Where can I buy Polyandrocarpamide B?
You can request a quote for Polyandrocarpamide B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Polyandrocarpamide B?
Yes, KEHONG BIO provides custom synthesis services for Polyandrocarpamide B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.