BAS 01057853
TL;DR: BAS 01057853 (CAS 314745-53-4) is a chemical compound with molecular formula C22H22N2O3 and molecular weight 362.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethyl-7-hydroxy-3-(1-methylbenzimidazol-2-yl)-2-propan-2-ylchromen-4-one
Also Known As: BAS 01057853, VU0509990-1, 6-ethyl-7-hydroxy-2-isopropyl-3-(1-methyl-1H-benzo[d]imidazol-2-yl)-4H-chromen-4-one, 6-ethyl-7-hydroxy-3-(1-methyl-1H-1,3-benzodiazol-2-yl)-2-(propan-2-yl)-4H-chromen-4-one, F3139-0036
| Molecular Formula | C22H22N2O3 |
|---|---|
| Molecular Weight | 362.16 g/mol |
| LogP | 4.7381 |
| Topological Polar Surface Area | 68.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.16306 |
| Heavy Atoms | 27 |
| Complexity | 1231.9932 |
Chemical Identifiers
| CAS Number | 314745-53-4 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1O)OC(=C(C2=O)C3=NC4=CC=CC=C4N3C)C(C)C |
Product Overview
BAS 01057853 (CAS 314745-53-4), with molecular formula C22H22N2O3 and molecular weight 362.16 g/mol. IUPAC: 6-ethyl-7-hydroxy-3-(1-methylbenzimidazol-2-yl)-2-propan-2-ylchromen-4-one.
Chemical Property Profile of BAS 01057853
Property Insights of BAS 01057853
The XLogP value of 4.7381 indicates that BAS 01057853 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.26 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01057853. Following Lipinski's Rule of Five, BAS 01057853 has 1 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 01057853?
The CAS number of BAS 01057853 is 314745-53-4.
What is the molecular formula of BAS 01057853?
The molecular formula of BAS 01057853 is C22H22N2O3.
What is the molecular weight of BAS 01057853?
The molecular weight of BAS 01057853 is 362.16 g/mol.
Where can I buy BAS 01057853?
You can request a quote for BAS 01057853 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01057853?
Yes, KEHONG BIO provides custom synthesis services for BAS 01057853 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.