Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)-
TL;DR: Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)- (CAS 64398-22-7) is a chemical compound with molecular formula C12H10Cl2N4 and molecular weight 280.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(aziridin-1-yl)-6-chloro-N-(4-chlorophenyl)pyrimidin-2-amine
Also Known As: 6-Aziridino-4-chloro-2-p-chloranilinopyrimidine, Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)-, 4-Chloro-6-ethyleneimino-2-p-chloranilinopyrimidine, 4-25-00-02791 (Beilstein Handbook Reference), 4-(aziridin-1-yl)-6-chloro-N-(4-chlorophenyl)pyrimidin-2-amine
| Molecular Formula | C12H10Cl2N4 |
|---|---|
| Molecular Weight | 280.03 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 40.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.02826 |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 64398-22-7 |
|---|---|
| SMILES | C1CN1C2=CC(=NC(=N2)NC3=CC=C(C=C3)Cl)Cl |
| InChIKey | VWMJYUMCUHALPX-UHFFFAOYSA-N |
Product Overview
Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)- (CAS 64398-22-7), with molecular formula C12H10Cl2N4 and molecular weight 280.03 g/mol. IUPAC: 4-(aziridin-1-yl)-6-chloro-N-(4-chlorophenyl)pyrimidin-2-amine.
Chemical Property Profile of Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)-
Property Insights of Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)-
The XLogP value of 3.9 indicates that Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.8 Ų, Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)- has 1 hydrogen bond donor(s) and 4 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 Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)-?
The CAS number of Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)- is 64398-22-7.
What is the molecular formula of Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)-?
The molecular formula of Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)- is C12H10Cl2N4.
What is the molecular weight of Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)-?
The molecular weight of Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)- is 280.03 g/mol.
Where can I buy Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)-?
You can request a quote for Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine, 6-aziridino-4-chloro-2-(p-chloroanilino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.