N-Desmethylflunitrazepam
TL;DR: N-Desmethylflunitrazepam (CAS 2648-00-2) is a chemical compound with molecular formula C15H11FN2O and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-fluoro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
Also Known As: N-Demethylflunitrazepam, N-Desmethylflunitrazepam, Ro-05-3061, Ro-5-3061, Ro 05-3061
| Molecular Formula | C15H11FN2O |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.08554 |
| Heavy Atoms | 19 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 2648-00-2 |
|---|---|
| SMILES | C1C(=O)NC2=C(C=C(C=C2)F)C(=N1)C3=CC=CC=C3 |
| InChIKey | BHRKXOYRRFPATI-UHFFFAOYSA-N |
Product Overview
N-Desmethylflunitrazepam (CAS 2648-00-2), with molecular formula C15H11FN2O and molecular weight 254.09 g/mol. IUPAC: 7-fluoro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one.
Chemical Property Profile of N-Desmethylflunitrazepam
Property Insights of N-Desmethylflunitrazepam
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Desmethylflunitrazepam. With a topological polar surface area (TPSA) of 41.5 Ų, N-Desmethylflunitrazepam exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Desmethylflunitrazepam has 1 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 N-Desmethylflunitrazepam?
The CAS number of N-Desmethylflunitrazepam is 2648-00-2.
What is the molecular formula of N-Desmethylflunitrazepam?
The molecular formula of N-Desmethylflunitrazepam is C15H11FN2O.
What is the molecular weight of N-Desmethylflunitrazepam?
The molecular weight of N-Desmethylflunitrazepam is 254.09 g/mol.
Where can I buy N-Desmethylflunitrazepam?
You can request a quote for N-Desmethylflunitrazepam directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Desmethylflunitrazepam?
Yes, KEHONG BIO provides custom synthesis services for N-Desmethylflunitrazepam and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.