1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone
TL;DR: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone (CAS 303985-98-0) is a chemical compound with molecular formula C12H13ClF3N3O and molecular weight 307.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-3,3-dimethylazetidin-2-one
Also Known As: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone, 1-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl](methyl)amino}-3,3-dimethylazetidin-2-one, 11L-734, 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-methylamino]-3,3-dimethylazetidin-2-one, 1-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]-methyl-amino]-3,3-dimethyl-azetidin-2-one
| Molecular Formula | C12H13ClF3N3O |
|---|---|
| Molecular Weight | 307.07 g/mol |
| LogP | 2.9734 |
| Topological Polar Surface Area | 36.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.06992 |
| Heavy Atoms | 20 |
| Complexity | 559.3688 |
Chemical Identifiers
| CAS Number | 303985-98-0 |
|---|---|
| SMILES | CC1(CN(C1=O)N(C)C2=C(C=C(C=N2)C(F)(F)F)Cl)C |
Product Overview
1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone (CAS 303985-98-0), with molecular formula C12H13ClF3N3O and molecular weight 307.07 g/mol. IUPAC: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-3,3-dimethylazetidin-2-one.
Chemical Property Profile of 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone
Property Insights of 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone
The XLogP value of 2.9734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone. With a topological polar surface area (TPSA) of 36.44 Ų, 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone has 0 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 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone?
The CAS number of 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone is 303985-98-0.
What is the molecular formula of 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone?
The molecular formula of 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone is C12H13ClF3N3O.
What is the molecular weight of 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone?
The molecular weight of 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone is 307.07 g/mol.
Where can I buy 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone?
You can request a quote for 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-3,3-dimethyl-2-azetanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.