STOML3 inhibitor OB-1
TL;DR: STOML3 inhibitor OB-1 (CAS 300803-69-4) is a chemical compound with molecular formula C21H17N3O6 and molecular weight 407.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(3-methyl-5-nitroimidazol-4-yl)oxy-2-phenyl-1-benzofuran-3-carboxylate
Also Known As: STOML3 inhibitor OB-1, STOML3 inhibitor OB-1?, BAS 01057792, Ethyl 5-(1-methyl-4-nitro-1H-imidazol-5-yloxy)-2-phenylbenzofuran-3-carboxylate, Ethyl5-(1-methyl-4-nitro-1H-imidazol-5-yloxy)-2-phenylbenzofuran-3-carboxylate
| Molecular Formula | C21H17N3O6 |
|---|---|
| Molecular Weight | 407.11 g/mol |
| LogP | 4.7105 |
| Topological Polar Surface Area | 109.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.11172 |
| Heavy Atoms | 30 |
| Complexity | 1242.6057 |
Chemical Identifiers
| CAS Number | 300803-69-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC3=C(N=CN3C)[N+](=O)[O-])C4=CC=CC=C4 |
Product Overview
STOML3 inhibitor OB-1 (CAS 300803-69-4), with molecular formula C21H17N3O6 and molecular weight 407.11 g/mol. IUPAC: ethyl 5-(3-methyl-5-nitroimidazol-4-yl)oxy-2-phenyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of STOML3 inhibitor OB-1
Property Insights of STOML3 inhibitor OB-1
The XLogP value of 4.7105 indicates that STOML3 inhibitor OB-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.63 Ų falls within the moderate polarity range, balancing permeability and solubility for STOML3 inhibitor OB-1. Following Lipinski's Rule of Five, STOML3 inhibitor OB-1 has 0 hydrogen bond donor(s) and 7 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 STOML3 inhibitor OB-1?
The CAS number of STOML3 inhibitor OB-1 is 300803-69-4.
What is the molecular formula of STOML3 inhibitor OB-1?
The molecular formula of STOML3 inhibitor OB-1 is C21H17N3O6.
What is the molecular weight of STOML3 inhibitor OB-1?
The molecular weight of STOML3 inhibitor OB-1 is 407.11 g/mol.
Where can I buy STOML3 inhibitor OB-1?
You can request a quote for STOML3 inhibitor OB-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for STOML3 inhibitor OB-1?
Yes, KEHONG BIO provides custom synthesis services for STOML3 inhibitor OB-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.