(C21-H24-O4.C6-H15-N3)x-
TL;DR: (C21-H24-O4.C6-H15-N3)x- (CAS 110813-95-1) is a chemical compound with molecular formula C27H39N3O4 and molecular weight 469.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]methyl]oxirane;2-piperazin-1-ylethanamine
Also Known As: (C21-H24-O4.C6-H15-N3)x-, 1-Piperazineethanamine, polymer with 2,2'-((1-methylethylidene)bis(4,1-phenyleneoxymethylene))bis(oxirane), 2,2'-((1-Methylethylidene)bis(4,1-phenyleneoxymethylene))bis(oxirane) 2-aminoethyl-1-piperazine polymer, 1-Piperazineethanamine, polymer with 2,2'-[(1-methylethylidene)bis(4,1-phenyleneoxymethylene)]bis[oxirane], 1-Piperazineethanamine, polymer with 2,2'-[(1-methylethylidene) bis(4,1-phenyleneoxymethylene)]bis[oxirane]
| Molecular Formula | C27H39N3O4 |
|---|---|
| Molecular Weight | 469.29 g/mol |
| LogP | 2.418 |
| Topological Polar Surface Area | 84.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 469.29407 |
| Heavy Atoms | 34 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 110813-95-1 |
|---|---|
| SMILES | CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4.C1CN(CCN1)CCN |
| InChIKey | RYQHZELRJHDUNB-UHFFFAOYSA-N |
Product Overview
(C21-H24-O4.C6-H15-N3)x- (CAS 110813-95-1), with molecular formula C27H39N3O4 and molecular weight 469.29 g/mol. IUPAC: 2-[[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]methyl]oxirane;2-piperazin-1-ylethanamine.
Chemical Property Profile of (C21-H24-O4.C6-H15-N3)x-
Property Insights of (C21-H24-O4.C6-H15-N3)x-
The XLogP value of 2.418 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (C21-H24-O4.C6-H15-N3)x-. The TPSA of 84.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (C21-H24-O4.C6-H15-N3)x-. Following Lipinski's Rule of Five, (C21-H24-O4.C6-H15-N3)x- has 2 hydrogen bond donor(s) and 7 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 (C21-H24-O4.C6-H15-N3)x-?
The CAS number of (C21-H24-O4.C6-H15-N3)x- is 110813-95-1.
What is the molecular formula of (C21-H24-O4.C6-H15-N3)x-?
The molecular formula of (C21-H24-O4.C6-H15-N3)x- is C27H39N3O4.
What is the molecular weight of (C21-H24-O4.C6-H15-N3)x-?
The molecular weight of (C21-H24-O4.C6-H15-N3)x- is 469.29 g/mol.
Where can I buy (C21-H24-O4.C6-H15-N3)x-?
You can request a quote for (C21-H24-O4.C6-H15-N3)x- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (C21-H24-O4.C6-H15-N3)x-?
Yes, KEHONG BIO provides custom synthesis services for (C21-H24-O4.C6-H15-N3)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.