Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl-
TL;DR: Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl- (CAS 64414-79-5) is a chemical compound with molecular formula C12H9Cl2N3 and molecular weight 265.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(aziridin-1-yl)-5,6-dichloro-2-phenylpyrimidine
Also Known As: 6-Aziridino-4,5-dichloro-2-phenylpyrimidine, Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl-, 4-(aziridin-1-yl)-5,6-dichloro-2-phenylpyrimidine, 2,5-Dichloro-6-ethyleneimino-2-phenylpyrimidine, 6-(1-Aziridinyl)-4,5-dichloro-2-phenylpyrimidine
| Molecular Formula | C12H9Cl2N3 |
|---|---|
| Molecular Weight | 265.02 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 28.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.01736 |
| Heavy Atoms | 17 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 64414-79-5 |
|---|---|
| SMILES | C1CN1C2=C(C(=NC(=N2)C3=CC=CC=C3)Cl)Cl |
| InChIKey | ONZBWWSQWGHIKE-UHFFFAOYSA-N |
Product Overview
Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl- (CAS 64414-79-5), with molecular formula C12H9Cl2N3 and molecular weight 265.02 g/mol. IUPAC: 4-(aziridin-1-yl)-5,6-dichloro-2-phenylpyrimidine.
Chemical Property Profile of Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl-
Property Insights of Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl-
The XLogP value of 3.7 indicates that Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.8 Ų, Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl- 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 Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl-?
The CAS number of Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl- is 64414-79-5.
What is the molecular formula of Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl-?
The molecular formula of Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl- is C12H9Cl2N3.
What is the molecular weight of Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl-?
The molecular weight of Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl- is 265.02 g/mol.
Where can I buy Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl-?
You can request a quote for Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl- 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-4,5-dichloro-2-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine, 6-aziridino-4,5-dichloro-2-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.