RefChem:270754
TL;DR: RefChem:270754 (CAS 85123-69-9) is a chemical compound with molecular formula C15H15N3O2 and molecular weight 269.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)-1,3,4,5-tetrahydro-1-benzazepin-2-one
Also Known As: Pyridine,2-(3-bromobenzo[b]thien-2-yl), 5-(2,3,4,5-Tetrahydro-2-oxo-1H-1-benzazepin-7-yl)-3,4-diazabicyclo(4.1.0)hept-4-en-2-one, 2-(2,3,4,5-Tetrahydro-benzo(b)azepin-2(1H)-on-7-yl)-3,4-diazabicyclo(4.1.0)hept-2-en-5-one, 3,4-Diazabicyclo(4.1.0)hept-4-en-2-one, 5-(2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-7-yl)-, 7-(5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)-1,3,4,5-tetrahydro-1-benzazepin-2-one
| Molecular Formula | C15H15N3O2 |
|---|---|
| Molecular Weight | 269.12 g/mol |
| LogP | 1.4314 |
| Topological Polar Surface Area | 70.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.11642 |
| Heavy Atoms | 20 |
| Complexity | 650.51874 |
Chemical Identifiers
| CAS Number | 85123-69-9 |
|---|---|
| SMILES | C1CC2=C(C=CC(=C2)C3=NNC(=O)C4C3C4)NC(=O)C1 |
Product Overview
RefChem:270754 (CAS 85123-69-9), with molecular formula C15H15N3O2 and molecular weight 269.12 g/mol. IUPAC: 7-(5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)-1,3,4,5-tetrahydro-1-benzazepin-2-one.
Chemical Property Profile of RefChem:270754
Property Insights of RefChem:270754
The XLogP value of 1.4314 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:270754. The TPSA of 70.56 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:270754. Following Lipinski's Rule of Five, RefChem:270754 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 RefChem:270754?
The CAS number of RefChem:270754 is 85123-69-9.
What is the molecular formula of RefChem:270754?
The molecular formula of RefChem:270754 is C15H15N3O2.
What is the molecular weight of RefChem:270754?
The molecular weight of RefChem:270754 is 269.12 g/mol.
Where can I buy RefChem:270754?
You can request a quote for RefChem:270754 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:270754?
Yes, KEHONG BIO provides custom synthesis services for RefChem:270754 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.