9H-Purine, 6-aziridinyl-9-benzyl-2-chloro-
TL;DR: 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro- (CAS 92291-23-1) is a chemical compound with molecular formula C14H12ClN5 and molecular weight 285.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(aziridin-1-yl)-9-benzyl-2-chloropurine
Also Known As: 6-(Aziridin-1-yl)-9-benzyl-2-chloro-9H-purine, 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro-, 6-(aziridin-1-yl)-9-benzyl-2-chloropurine, 6-aziridin-1-yl-9-benzyl-2-chloro-9H-purine, 9-Benzyl-2-chlor-6-aziridinyl-(1)-9H-purin
| Molecular Formula | C14H12ClN5 |
|---|---|
| Molecular Weight | 285.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.07812 |
| Heavy Atoms | 20 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 92291-23-1 |
|---|---|
| SMILES | C1CN1C2=NC(=NC3=C2N=CN3CC4=CC=CC=C4)Cl |
| InChIKey | NNZIPUWEWYCMBT-UHFFFAOYSA-N |
Product Overview
9H-Purine, 6-aziridinyl-9-benzyl-2-chloro- (CAS 92291-23-1), with molecular formula C14H12ClN5 and molecular weight 285.08 g/mol. IUPAC: 6-(aziridin-1-yl)-9-benzyl-2-chloropurine.
Chemical Property Profile of 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro-
Property Insights of 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro-. With a topological polar surface area (TPSA) of 46.6 Ų, 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro- has 0 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 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro-?
The CAS number of 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro- is 92291-23-1.
What is the molecular formula of 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro-?
The molecular formula of 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro- is C14H12ClN5.
What is the molecular weight of 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro-?
The molecular weight of 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro- is 285.08 g/mol.
Where can I buy 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro-?
You can request a quote for 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro-?
Yes, KEHONG BIO provides custom synthesis services for 9H-Purine, 6-aziridinyl-9-benzyl-2-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.