RO-5-4933 free base
TL;DR: RO-5-4933 free base (CAS 2890-28-0) is a chemical compound with molecular formula C16H13F3N2 and molecular weight 290.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-7-(trifluoromethyl)-2,3-dihydro-1H-1,4-benzodiazepine
Also Known As: RO-5-4933 free base, 2,3-Dihydro-5-phenyl-7-(trifluoromethyl)-1H-1,4-benzodiazepine, 5-23-09-00075 (Beilstein Handbook Reference), 1H-1,4-BENZODIAZEPINE, 2,3-DIHYDRO-5-PHENYL-7-(TRIFLUOROMETHYL)-, 5-phenyl-7-(trifluoromethyl)-2,3-dihydro-1H-1,4-benzodiazepine
| Molecular Formula | C16H13F3N2 |
|---|---|
| Molecular Weight | 290.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.1031 |
| Heavy Atoms | 21 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 2890-28-0 |
|---|---|
| SMILES | C1CN=C(C2=C(N1)C=CC(=C2)C(F)(F)F)C3=CC=CC=C3 |
| InChIKey | UVIWKJUMUWEHQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RO-5-4933 free base (CAS 2890-28-0), with molecular formula C16H13F3N2 and molecular weight 290.10 g/mol. IUPAC: 5-phenyl-7-(trifluoromethyl)-2,3-dihydro-1H-1,4-benzodiazepine.
Chemical Property Profile of RO-5-4933 free base
Property Insights of RO-5-4933 free base
The XLogP value of 3.8 indicates that RO-5-4933 free base is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.4 Ų, RO-5-4933 free base exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RO-5-4933 free base has 1 hydrogen bond donor(s) and 5 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 RO-5-4933 free base?
The CAS number of RO-5-4933 free base is 2890-28-0.
What is the molecular formula of RO-5-4933 free base?
The molecular formula of RO-5-4933 free base is C16H13F3N2.
What is the molecular weight of RO-5-4933 free base?
The molecular weight of RO-5-4933 free base is 290.10 g/mol.
Where can I buy RO-5-4933 free base?
You can request a quote for RO-5-4933 free base directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RO-5-4933 free base?
Yes, KEHONG BIO provides custom synthesis services for RO-5-4933 free base and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.