2-(1-Aziridinyl)-4,6-dichloropyrimidine
TL;DR: 2-(1-Aziridinyl)-4,6-dichloropyrimidine (CAS 4238-91-9) is a chemical compound with molecular formula C6H5Cl2N3 and molecular weight 188.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(aziridin-1-yl)-4,6-dichloropyrimidine
Also Known As: Pyrimidine,6-dichloro-, 2-Aziridino-4,6-dichloropyrimidine, Pyrimidine, 2-aziridino-4,6-dichloro-, 4,6-Dichloro-2-ethyleneiminopyrimidine, 2-(aziridin-1-yl)-4,6-dichloropyrimidine
| Molecular Formula | C6H5Cl2N3 |
|---|---|
| Molecular Weight | 188.99 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 28.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.98605 |
| Heavy Atoms | 11 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 4238-91-9 |
|---|---|
| SMILES | C1CN1C2=NC(=CC(=N2)Cl)Cl |
| InChIKey | QIECOKJMZNNZML-UHFFFAOYSA-N |
Product Overview
2-(1-Aziridinyl)-4,6-dichloropyrimidine (CAS 4238-91-9), with molecular formula C6H5Cl2N3 and molecular weight 188.99 g/mol. IUPAC: 2-(aziridin-1-yl)-4,6-dichloropyrimidine.
Chemical Property Profile of 2-(1-Aziridinyl)-4,6-dichloropyrimidine
Property Insights of 2-(1-Aziridinyl)-4,6-dichloropyrimidine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Aziridinyl)-4,6-dichloropyrimidine. With a topological polar surface area (TPSA) of 28.8 Ų, 2-(1-Aziridinyl)-4,6-dichloropyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Aziridinyl)-4,6-dichloropyrimidine 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 2-(1-Aziridinyl)-4,6-dichloropyrimidine?
The CAS number of 2-(1-Aziridinyl)-4,6-dichloropyrimidine is 4238-91-9.
What is the molecular formula of 2-(1-Aziridinyl)-4,6-dichloropyrimidine?
The molecular formula of 2-(1-Aziridinyl)-4,6-dichloropyrimidine is C6H5Cl2N3.
What is the molecular weight of 2-(1-Aziridinyl)-4,6-dichloropyrimidine?
The molecular weight of 2-(1-Aziridinyl)-4,6-dichloropyrimidine is 188.99 g/mol.
Where can I buy 2-(1-Aziridinyl)-4,6-dichloropyrimidine?
You can request a quote for 2-(1-Aziridinyl)-4,6-dichloropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Aziridinyl)-4,6-dichloropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Aziridinyl)-4,6-dichloropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.