UPCMLD0ENAT0502-5673:001
TL;DR: UPCMLD0ENAT0502-5673:001 (CAS 1092973-64-2) is a chemical compound with molecular formula C14H15Cl4F3N2O2 and molecular weight 439.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-chloro-4-(trifluoromethyl)anilino]-3-methyl-N-(2,2,2-trichloro-1-hydroxyethyl)butanamide
Also Known As: UPCMLD0ENAT0502-5673:001, 2-[2-chloro-4-(trifluoromethyl)anilino]-3-methyl-N-(2,2,2-trichloro-1-hydroxyethyl)butanamide, AE-848/12560191
| Molecular Formula | C14H15Cl4F3N2O2 |
|---|---|
| Molecular Weight | 439.98 g/mol |
| LogP | 4.6001 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.98398 |
| Heavy Atoms | 25 |
| Complexity | 621.0749 |
Chemical Identifiers
| CAS Number | 1092973-64-2 |
|---|---|
| SMILES | CC(C)C(C(=O)NC(C(Cl)(Cl)Cl)O)NC1=C(C=C(C=C1)C(F)(F)F)Cl |
Product Overview
UPCMLD0ENAT0502-5673:001 (CAS 1092973-64-2), with molecular formula C14H15Cl4F3N2O2 and molecular weight 439.98 g/mol. IUPAC: 2-[2-chloro-4-(trifluoromethyl)anilino]-3-methyl-N-(2,2,2-trichloro-1-hydroxyethyl)butanamide.
Chemical Property Profile of UPCMLD0ENAT0502-5673:001
Property Insights of UPCMLD0ENAT0502-5673:001
The XLogP value of 4.6001 indicates that UPCMLD0ENAT0502-5673:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0502-5673:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0502-5673:001 has 3 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 UPCMLD0ENAT0502-5673:001?
The CAS number of UPCMLD0ENAT0502-5673:001 is 1092973-64-2.
What is the molecular formula of UPCMLD0ENAT0502-5673:001?
The molecular formula of UPCMLD0ENAT0502-5673:001 is C14H15Cl4F3N2O2.
What is the molecular weight of UPCMLD0ENAT0502-5673:001?
The molecular weight of UPCMLD0ENAT0502-5673:001 is 439.98 g/mol.
Where can I buy UPCMLD0ENAT0502-5673:001?
You can request a quote for UPCMLD0ENAT0502-5673:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0502-5673:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0502-5673:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.