Bionet1_001274
TL;DR: Bionet1_001274 (CAS 338422-61-0) is a chemical compound with molecular formula C15H16ClF3N4O2 and molecular weight 376.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]methyl]-4,5-dihydro-1,2-oxazol-3-yl]-3-(dimethylamino)prop-2-en-1-one
Also Known As: Bionet1_001274, 1-[5-({[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}methyl)-4,5-dihydro-3-isoxazolyl]-3-(dimethylamino)-2-propen-1-one, 1-[5-[[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]methyl]-4,5-dihydro-1,2-oxazol-3-yl]-3-(dimethylamino)prop-2-en-1-one
| Molecular Formula | C15H16ClF3N4O2 |
|---|---|
| Molecular Weight | 376.09 g/mol |
| LogP | 2.955 |
| Topological Polar Surface Area | 66.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 376.0914 |
| Heavy Atoms | 25 |
| Complexity | 704.50714 |
Chemical Identifiers
| CAS Number | 338422-61-0 |
|---|---|
| SMILES | CN(C)C=CC(=O)C1=NOC(C1)CNC2=C(C=C(C=N2)C(F)(F)F)Cl |
Product Overview
Bionet1_001274 (CAS 338422-61-0), with molecular formula C15H16ClF3N4O2 and molecular weight 376.09 g/mol. IUPAC: 1-[5-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]methyl]-4,5-dihydro-1,2-oxazol-3-yl]-3-(dimethylamino)prop-2-en-1-one.
Chemical Property Profile of Bionet1_001274
Property Insights of Bionet1_001274
The XLogP value of 2.955 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_001274. The TPSA of 66.82 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_001274. Following Lipinski's Rule of Five, Bionet1_001274 has 1 hydrogen bond donor(s) and 6 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_001274?
The CAS number of Bionet1_001274 is 338422-61-0.
What is the molecular formula of Bionet1_001274?
The molecular formula of Bionet1_001274 is C15H16ClF3N4O2.
What is the molecular weight of Bionet1_001274?
The molecular weight of Bionet1_001274 is 376.09 g/mol.
Where can I buy Bionet1_001274?
You can request a quote for Bionet1_001274 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_001274?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_001274 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.