AP-064/15228817
TL;DR: AP-064/15228817 (CAS 407589-99-5) is a chemical compound with molecular formula C27H31N3O3S and molecular weight 477.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[6-tert-butyl-3-[(2-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide
Also Known As: AP-064/15228817, N-[6-tert-butyl-3-[(2-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide, N-{6-TERT-BUTYL-3-[(2-ETHOXYPHENYL)CARBAMOYL]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-2-YL}PYRIDINE-4-CARBOXAMIDE, N-(6-tert-butyl-3-{[(2-ethoxyphenyl)amino]carbonyl}-4,5,6,7-tetrahydro-1-benzothien-2-yl)isonicotinamide, N-{6-tert-butyl-3-[(2-ethoxyanilino)carbonyl]-4,5,6,7-tetrahydro-1-benzothien-2-yl}isonicotinamide
| Molecular Formula | C27H31N3O3S |
|---|---|
| Molecular Weight | 477.21 g/mol |
| LogP | 6.1974 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 477.20862 |
| Heavy Atoms | 34 |
| Complexity | 1181.5762 |
Chemical Identifiers
| CAS Number | 407589-99-5 |
|---|---|
| SMILES | CCOC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)NC(=O)C4=CC=NC=C4 |
Product Overview
AP-064/15228817 (CAS 407589-99-5), with molecular formula C27H31N3O3S and molecular weight 477.21 g/mol. IUPAC: N-[6-tert-butyl-3-[(2-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide.
Chemical Property Profile of AP-064/15228817
Property Insights of AP-064/15228817
The XLogP value of 6.1974 indicates that AP-064/15228817 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-064/15228817. Following Lipinski's Rule of Five, AP-064/15228817 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AP-064/15228817?
The CAS number of AP-064/15228817 is 407589-99-5.
What is the molecular formula of AP-064/15228817?
The molecular formula of AP-064/15228817 is C27H31N3O3S.
What is the molecular weight of AP-064/15228817?
The molecular weight of AP-064/15228817 is 477.21 g/mol.
Where can I buy AP-064/15228817?
You can request a quote for AP-064/15228817 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-064/15228817?
Yes, KEHONG BIO provides custom synthesis services for AP-064/15228817 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.