Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)-
TL;DR: Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)- (CAS 108260-35-1) is a chemical compound with molecular formula C12H12ClNO2 and molecular weight 237.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(aziridin-1-yl)-4-(4-chlorophenyl)butane-1,4-dione
Also Known As: beta-(p-Chlorobenzoyl)propionic acid aziridinylamide, 1-(4-(4-Chlorophenyl)-1,4-dioxobutyl)aziridine, AZIRIDINE, 1-(4-(4-CHLOROPHENYL)-1,4-DIOXOBUTYL)-, 1-(aziridin-1-yl)-4-(4-chlorophenyl)butane-1,4-dione, RefChem:320412
| Molecular Formula | C12H12ClNO2 |
|---|---|
| Molecular Weight | 237.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 37.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.05565 |
| Heavy Atoms | 16 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 108260-35-1 |
|---|---|
| SMILES | C1CN1C(=O)CCC(=O)C2=CC=C(C=C2)Cl |
| InChIKey | APZBWYWJSUGDDX-UHFFFAOYSA-N |
Product Overview
Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)- (CAS 108260-35-1), with molecular formula C12H12ClNO2 and molecular weight 237.06 g/mol. IUPAC: 1-(aziridin-1-yl)-4-(4-chlorophenyl)butane-1,4-dione.
Chemical Property Profile of Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)-
Property Insights of Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)-. With a topological polar surface area (TPSA) of 37.2 Ų, Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)- has 0 hydrogen bond donor(s) and 2 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 Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)-?
The CAS number of Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)- is 108260-35-1.
What is the molecular formula of Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)-?
The molecular formula of Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)- is C12H12ClNO2.
What is the molecular weight of Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)-?
The molecular weight of Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)- is 237.06 g/mol.
Where can I buy Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)-?
You can request a quote for Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)-?
Yes, KEHONG BIO provides custom synthesis services for Aziridine, 1-(4-(4-chlorophenyl)-1,4-dioxobutyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.