Bionet1_002955
TL;DR: Bionet1_002955 (CAS 321998-77-0) is a chemical compound with molecular formula C17H15ClF3N3O2 and molecular weight 385.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: Bionet1_002955, 4-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione, 8L-918, 4-(2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}ethyl)-4-azatricyclo[5.2.1.0^{2,6}]dec-8-ene-3,5-dione, 4-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
| Molecular Formula | C17H15ClF3N3O2 |
|---|---|
| Molecular Weight | 385.08 g/mol |
| LogP | 2.9728 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.08047 |
| Heavy Atoms | 26 |
| Complexity | 780.9331 |
Chemical Identifiers
| CAS Number | 321998-77-0 |
|---|---|
| SMILES | C1C2C=CC1C3C2C(=O)N(C3=O)CCNC4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
Bionet1_002955 (CAS 321998-77-0), with molecular formula C17H15ClF3N3O2 and molecular weight 385.08 g/mol. IUPAC: 4-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Chemical Property Profile of Bionet1_002955
Property Insights of Bionet1_002955
The XLogP value of 2.9728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_002955. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002955. Following Lipinski's Rule of Five, Bionet1_002955 has 1 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 Bionet1_002955?
The CAS number of Bionet1_002955 is 321998-77-0.
What is the molecular formula of Bionet1_002955?
The molecular formula of Bionet1_002955 is C17H15ClF3N3O2.
What is the molecular weight of Bionet1_002955?
The molecular weight of Bionet1_002955 is 385.08 g/mol.
Where can I buy Bionet1_002955?
You can request a quote for Bionet1_002955 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002955?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002955 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.