Bionet1_004788
TL;DR: Bionet1_004788 (CAS 439111-46-3) is a chemical compound with molecular formula C23H25N3O2 and molecular weight 375.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-tert-butylbenzoyl)-N-(2-pyridin-2-ylethyl)-1H-pyrrole-2-carboxamide
Also Known As: Bionet1_004788, 4-(4-tert-butylbenzoyl)-N-[2-(pyridin-2-yl)ethyl]-1H-pyrrole-2-carboxamide, 4-[4-(tert-butyl)benzoyl]-N-[2-(2-pyridinyl)ethyl]-1H-pyrrole-2-carboxamide, 4-(4-tert-butylbenzoyl)-N-(2-pyridin-2-ylethyl)-1H-pyrrole-2-carboxamide, 4-[(4-tert-butylphenyl)-oxomethyl]-N-[2-(2-pyridinyl)ethyl]-1H-pyrrole-2-carboxamide
| Molecular Formula | C23H25N3O2 |
|---|---|
| Molecular Weight | 375.19 g/mol |
| LogP | 3.9107 |
| Topological Polar Surface Area | 74.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.19467 |
| Heavy Atoms | 28 |
| Complexity | 951.51746 |
Chemical Identifiers
| CAS Number | 439111-46-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CNC(=C2)C(=O)NCCC3=CC=CC=N3 |
Product Overview
Bionet1_004788 (CAS 439111-46-3), with molecular formula C23H25N3O2 and molecular weight 375.19 g/mol. IUPAC: 4-(4-tert-butylbenzoyl)-N-(2-pyridin-2-ylethyl)-1H-pyrrole-2-carboxamide.
Chemical Property Profile of Bionet1_004788
Property Insights of Bionet1_004788
The XLogP value of 3.9107 indicates that Bionet1_004788 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.85 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_004788. Following Lipinski's Rule of Five, Bionet1_004788 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 Bionet1_004788?
The CAS number of Bionet1_004788 is 439111-46-3.
What is the molecular formula of Bionet1_004788?
The molecular formula of Bionet1_004788 is C23H25N3O2.
What is the molecular weight of Bionet1_004788?
The molecular weight of Bionet1_004788 is 375.19 g/mol.
Where can I buy Bionet1_004788?
You can request a quote for Bionet1_004788 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_004788?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_004788 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.