![3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine structure](/static/products/4123/41230-61-9.webp)
3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine
TL;DR: 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine (CAS 41230-61-9) is a chemical compound with molecular formula C9H11N3O and molecular weight 177.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine
Also Known As: 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine
| Molecular Formula | C9H11N3O |
|---|---|
| Molecular Weight | 177.09 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.09021 |
| Heavy Atoms | 13 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 41230-61-9 |
|---|---|
| SMILES | CC1=NC2=C(N=C(C1)C)ON=C2C |
| InChIKey | AHGCJNYKXMLNDR-UHFFFAOYSA-N |
Product Overview
3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine (CAS 41230-61-9), with molecular formula C9H11N3O and molecular weight 177.09 g/mol. IUPAC: 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine.
Chemical Property Profile of 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine
Property Insights of 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine. With a topological polar surface area (TPSA) of 50.8 Ų, 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine has 0 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 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine?
The CAS number of 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine is 41230-61-9.
What is the molecular formula of 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine?
The molecular formula of 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine is C9H11N3O.
What is the molecular weight of 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine?
The molecular weight of 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine is 177.09 g/mol.
Where can I buy 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine?
You can request a quote for 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine?
Yes, KEHONG BIO provides custom synthesis services for 3,5,7-trimethyl-6H-[1,2]oxazolo[4,5-b][1,4]diazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.