UPCMLD0ENAT0517-1134:001
TL;DR: UPCMLD0ENAT0517-1134:001 (CAS 309740-31-6) is a chemical compound with molecular formula C28H25ClF3N3O2 and molecular weight 527.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-benzhydrylpiperazin-1-yl)-1-[4-chloro-3-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione
Also Known As: UPCMLD0ENAT0517-1134:001, A2279/0096013, 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(diphenylmethyl)piperazin-1-yl]pyrrolidine-2,5-dione, 3-(4-benzhydryl-1-piperazinyl)-1-[4-chloro-3-(trifluoromethyl)phenyl]-2,5-pyrrolidinedione, 3-(4-benzhydrylpiperazin-1-yl)-1-(4-chloro-3-(trifluoromethyl)phenyl)pyrrolidine-2,5-dione
| Molecular Formula | C28H25ClF3N3O2 |
|---|---|
| Molecular Weight | 527.16 g/mol |
| LogP | 5.3979 |
| Topological Polar Surface Area | 43.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 527.15875 |
| Heavy Atoms | 37 |
| Complexity | 1239.3348 |
Chemical Identifiers
| CAS Number | 309740-31-6 |
|---|---|
| SMILES | C1CN(CCN1C2CC(=O)N(C2=O)C3=CC(=C(C=C3)Cl)C(F)(F)F)C(C4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
UPCMLD0ENAT0517-1134:001 (CAS 309740-31-6), with molecular formula C28H25ClF3N3O2 and molecular weight 527.16 g/mol. IUPAC: 3-(4-benzhydrylpiperazin-1-yl)-1-[4-chloro-3-(trifluoromethyl)phenyl]pyrrolidine-2,5-dione.
Chemical Property Profile of UPCMLD0ENAT0517-1134:001
Property Insights of UPCMLD0ENAT0517-1134:001
The XLogP value of 5.3979 indicates that UPCMLD0ENAT0517-1134:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.86 Ų, UPCMLD0ENAT0517-1134:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0517-1134:001 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT0517-1134:001?
The CAS number of UPCMLD0ENAT0517-1134:001 is 309740-31-6.
What is the molecular formula of UPCMLD0ENAT0517-1134:001?
The molecular formula of UPCMLD0ENAT0517-1134:001 is C28H25ClF3N3O2.
What is the molecular weight of UPCMLD0ENAT0517-1134:001?
The molecular weight of UPCMLD0ENAT0517-1134:001 is 527.16 g/mol.
Where can I buy UPCMLD0ENAT0517-1134:001?
You can request a quote for UPCMLD0ENAT0517-1134:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0517-1134:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0517-1134:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.