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Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone]
TL;DR: Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone] (CAS 20792-40-9) is a chemical compound with molecular formula C18H21N3O3 and molecular weight 327.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,5-bis(2-methylaziridine-1-carbonyl)phenyl]-(2-methylaziridin-1-yl)methanone
Also Known As: benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone], J1.507.346B, 1,1''-Benzene-1,3,5-tricarbonyltris(2-methylaziridine, 1,1,1-Benzene-1,3,5-tricarbonyltris(2-methylaziridine, (Benzene-1,3,5-triyl)tris[(2-methylaziridin-1-yl)methanone]
| Molecular Formula | C18H21N3O3 |
|---|---|
| Molecular Weight | 327.16 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.1583 |
| Heavy Atoms | 24 |
| Complexity | 499.0 |
Chemical Identifiers
| CAS Number | 20792-40-9 |
|---|---|
| SMILES | CC1CN1C(=O)C2=CC(=CC(=C2)C(=O)N3CC3C)C(=O)N4CC4C |
| InChIKey | PBWSPPTYGLDOFW-UHFFFAOYSA-N |
Product Overview
Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone] (CAS 20792-40-9), with molecular formula C18H21N3O3 and molecular weight 327.16 g/mol. IUPAC: [3,5-bis(2-methylaziridine-1-carbonyl)phenyl]-(2-methylaziridin-1-yl)methanone.
Chemical Property Profile of Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone]
Property Insights of Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone]
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone]. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone]. Following Lipinski's Rule of Five, Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone] has 0 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 Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone]?
The CAS number of Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone] is 20792-40-9.
What is the molecular formula of Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone]?
The molecular formula of Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone] is C18H21N3O3.
What is the molecular weight of Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone]?
The molecular weight of Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone] is 327.16 g/mol.
Where can I buy Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone]?
You can request a quote for Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone]?
Yes, KEHONG BIO provides custom synthesis services for Benzene-1,3,5-triyltris[(2-methylaziridin-1-yl)methanone] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.