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[3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone
TL;DR: [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone (CAS 2980-56-5) is a chemical compound with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone
Also Known As: (1,3-Phenylene)bis[(aziridin-1-yl)methanone], [3-(aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone, Aziridine, 1,1'-(1,3-phenylenedicarbonyl)bis-, Aziridine, 1,1'-(1,3-phenylenedicarbonyl)bis- (9CI)
| Molecular Formula | C12H12N2O2 |
|---|---|
| Molecular Weight | 216.09 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 40.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.08987 |
| Heavy Atoms | 16 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 2980-56-5 |
|---|---|
| SMILES | C1CN1C(=O)C2=CC(=CC=C2)C(=O)N3CC3 |
| InChIKey | BPDCIDUBPNEWKU-UHFFFAOYSA-N |
Product Overview
[3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone (CAS 2980-56-5), with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol. IUPAC: [3-(aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone.
Chemical Property Profile of [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone
Property Insights of [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone. With a topological polar surface area (TPSA) of 40.2 Ų, [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone 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 [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone?
The CAS number of [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone is 2980-56-5.
What is the molecular formula of [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone?
The molecular formula of [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone is C12H12N2O2.
What is the molecular weight of [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone?
The molecular weight of [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone is 216.09 g/mol.
Where can I buy [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone?
You can request a quote for [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-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 [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [3-(Aziridine-1-carbonyl)phenyl]-(aziridin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.