Bionet1_002096
TL;DR: Bionet1_002096 (CAS 337920-09-9) is a chemical compound with molecular formula C14H10ClF3N4O4 and molecular weight 390.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-5-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: Bionet1_002096, 3-acetyl-5-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 10H-911, 3-acetyl-5-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-3aH,4H,5H,6H,6aH-pyrrolo[3,4-d][1,2]oxazole-4,6-dione, 3-acetyl-5-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-methylamino]-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione
| Molecular Formula | C14H10ClF3N4O4 |
|---|---|
| Molecular Weight | 390.03 g/mol |
| LogP | 1.4338 |
| Topological Polar Surface Area | 92.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.03427 |
| Heavy Atoms | 26 |
| Complexity | 857.0839 |
Chemical Identifiers
| CAS Number | 337920-09-9 |
|---|---|
| SMILES | CC(=O)C1=NOC2C1C(=O)N(C2=O)N(C)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
Bionet1_002096 (CAS 337920-09-9), with molecular formula C14H10ClF3N4O4 and molecular weight 390.03 g/mol. IUPAC: 3-acetyl-5-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of Bionet1_002096
Property Insights of Bionet1_002096
The XLogP value of 1.4338 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_002096. The TPSA of 92.17 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002096. Following Lipinski's Rule of Five, Bionet1_002096 has 0 hydrogen bond donor(s) and 7 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_002096?
The CAS number of Bionet1_002096 is 337920-09-9.
What is the molecular formula of Bionet1_002096?
The molecular formula of Bionet1_002096 is C14H10ClF3N4O4.
What is the molecular weight of Bionet1_002096?
The molecular weight of Bionet1_002096 is 390.03 g/mol.
Where can I buy Bionet1_002096?
You can request a quote for Bionet1_002096 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002096?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002096 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.