UPCMLD0ENAT0400-1259:001
TL;DR: UPCMLD0ENAT0400-1259:001 (CAS 3771-43-5) is a chemical compound with molecular formula C18H20F3N3O2S and molecular weight 399.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(2-hydroxyethyl)-3-methyl-4-[[4-(trifluoromethylsulfanyl)phenyl]diazenyl]anilino]ethanol
Also Known As: UPCMLD0ENAT0400-1259:001, Ethanol, 2,2'-[[3-methyl-4-[[4-[(trifluoromethyl)thio]phenyl]azo]phenyl]imino]bis- (9CI), Ethanol, 2,2'-[[3-methyl-4-[[4-[(trifluoromethyl)thio]phenyl]azo]phenyl]imino]bis-(9CI), 2-[N-(2-hydroxyethyl)-3-methyl-4-[[4-(trifluoromethylsulfanyl)phenyl]diazenyl]anilino]ethanol
| Molecular Formula | C18H20F3N3O2S |
|---|---|
| Molecular Weight | 399.12 g/mol |
| LogP | 4.81332 |
| Topological Polar Surface Area | 68.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 399.12283 |
| Heavy Atoms | 27 |
| Complexity | 761.43744 |
Chemical Identifiers
| CAS Number | 3771-43-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=CC=C(C=C2)SC(F)(F)F |
Product Overview
UPCMLD0ENAT0400-1259:001 (CAS 3771-43-5), with molecular formula C18H20F3N3O2S and molecular weight 399.12 g/mol. IUPAC: 2-[N-(2-hydroxyethyl)-3-methyl-4-[[4-(trifluoromethylsulfanyl)phenyl]diazenyl]anilino]ethanol.
Chemical Property Profile of UPCMLD0ENAT0400-1259:001
Property Insights of UPCMLD0ENAT0400-1259:001
The XLogP value of 4.81332 indicates that UPCMLD0ENAT0400-1259:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.42 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0400-1259:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0400-1259:001 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 UPCMLD0ENAT0400-1259:001?
The CAS number of UPCMLD0ENAT0400-1259:001 is 3771-43-5.
What is the molecular formula of UPCMLD0ENAT0400-1259:001?
The molecular formula of UPCMLD0ENAT0400-1259:001 is C18H20F3N3O2S.
What is the molecular weight of UPCMLD0ENAT0400-1259:001?
The molecular weight of UPCMLD0ENAT0400-1259:001 is 399.12 g/mol.
Where can I buy UPCMLD0ENAT0400-1259:001?
You can request a quote for UPCMLD0ENAT0400-1259:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0400-1259:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0400-1259:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.