BAS 12534092
TL;DR: BAS 12534092 (CAS 827007-90-9) is a chemical compound with molecular formula C19H22N6O and molecular weight 350.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]acetamide
Also Known As: BAS 12534092, N-[(E)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(1H-indol-3-yl)ethyl]amino}methylidene]acetamide, N''-ACETYL-N-(4,6-DIMETHYL-2-PYRIMIDINYL)-N'-[2-(1H-INDOL-3-YL)ETHYL]GUANIDINE, N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]acetamide, (E)-N-(((2-(1H-indol-3-yl)ethyl)amino)((4,6-dimethylpyrimidin-2-yl)amino)methylene)acetamide
| Molecular Formula | C19H22N6O |
|---|---|
| Molecular Weight | 350.19 g/mol |
| LogP | 2.72144 |
| Topological Polar Surface Area | 95.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.18552 |
| Heavy Atoms | 26 |
| Complexity | 939.3227 |
Chemical Identifiers
| CAS Number | 827007-90-9 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=CC=CC=C32)NC(=O)C)C |
Product Overview
BAS 12534092 (CAS 827007-90-9), with molecular formula C19H22N6O and molecular weight 350.19 g/mol. IUPAC: N-[N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]acetamide.
Chemical Property Profile of BAS 12534092
Property Insights of BAS 12534092
The XLogP value of 2.72144 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12534092. The TPSA of 95.06 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12534092. Following Lipinski's Rule of Five, BAS 12534092 has 3 hydrogen bond donor(s) and 4 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 BAS 12534092?
The CAS number of BAS 12534092 is 827007-90-9.
What is the molecular formula of BAS 12534092?
The molecular formula of BAS 12534092 is C19H22N6O.
What is the molecular weight of BAS 12534092?
The molecular weight of BAS 12534092 is 350.19 g/mol.
Where can I buy BAS 12534092?
You can request a quote for BAS 12534092 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12534092?
Yes, KEHONG BIO provides custom synthesis services for BAS 12534092 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.