Pellit
TL;DR: Pellit (CAS 90686-45-6) is a chemical compound with molecular formula C39H48N2O6 and molecular weight 640.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzhydryloxy-N,N-dimethylethanamine;N,N-diethyl-3-methylbenzamide;dimethyl benzene-1,2-dicarboxylate
Also Known As: Pellit, 2-benzhydryloxy-n,n-dimethyl-ethanamine; n,n-diethyl-3-methyl-benzamide; dimethyl benzene-1,2-dicarboxylate, 2-benzhydryloxy-N,N-dimethylethanamine;N,N-diethyl-3-methylbenzamide;dimethyl benzene-1,2-dicarboxylate, 2-benzhydryloxy-N,N-dimethylethanamine; N,N-diethyl-3-methylbenzamide; dimethyl benzene-1,2-dicarboxylate
| Molecular Formula | C39H48N2O6 |
|---|---|
| Molecular Weight | 640.35 g/mol |
| LogP | 7.09102 |
| Topological Polar Surface Area | 85.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 640.35126 |
| Heavy Atoms | 47 |
| Complexity | 598.0 |
Chemical Identifiers
| CAS Number | 90686-45-6 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=CC=CC(=C1)C.CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2.COC(=O)C1=CC=CC=C1C(=O)OC |
| InChIKey | DALHQHRHNDNUEU-UHFFFAOYSA-N |
Product Overview
Pellit (CAS 90686-45-6), with molecular formula C39H48N2O6 and molecular weight 640.35 g/mol. IUPAC: 2-benzhydryloxy-N,N-dimethylethanamine;N,N-diethyl-3-methylbenzamide;dimethyl benzene-1,2-dicarboxylate.
Chemical Property Profile of Pellit
Property Insights of Pellit
The XLogP value of 7.09102 indicates that Pellit is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Pellit. Following Lipinski's Rule of Five, Pellit has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pellit?
The CAS number of Pellit is 90686-45-6.
What is the molecular formula of Pellit?
The molecular formula of Pellit is C39H48N2O6.
What is the molecular weight of Pellit?
The molecular weight of Pellit is 640.35 g/mol.
Where can I buy Pellit?
You can request a quote for Pellit directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pellit?
Yes, KEHONG BIO provides custom synthesis services for Pellit and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.