![2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide structure](/static/products/2554/2554-18-9.webp)
2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide
TL;DR: 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide (CAS 2554-18-9) 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.
2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide
Also Known As: 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide, 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylidenea, (Chloro-trifluoromethyl-phenylamino)-acetic acid isopropylidene-hydrazide, 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(isopropylideneamino)acetamide, 2-[4-Chloro-3-(trifluoromethyl)anilino]-N'-(propan-2-ylidene)acetohydrazide
| Molecular Formula | C12H13ClF3N3O |
|---|---|
| Molecular Weight | 307.07 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 53.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.06992 |
| Heavy Atoms | 20 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 2554-18-9 |
|---|---|
| SMILES | CC(=NNC(=O)CNC1=CC(=C(C=C1)Cl)C(F)(F)F)C |
| InChIKey | VEUDZDBHDUTSJW-UHFFFAOYSA-N |
Product Overview
2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide (CAS 2554-18-9), with molecular formula C12H13ClF3N3O and molecular weight 307.07 g/mol. IUPAC: 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide.
Chemical Property Profile of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide
Property Insights of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide
The XLogP value of 3.0 indicates that 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.5 Ų, 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide has 2 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 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide?
The CAS number of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide is 2554-18-9.
What is the molecular formula of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide?
The molecular formula of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide is C12H13ClF3N3O.
What is the molecular weight of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide?
The molecular weight of 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide is 307.07 g/mol.
Where can I buy 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide?
You can request a quote for 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-chloro-3-(trifluoromethyl)anilino]-N-(propan-2-ylideneamino)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.