7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine
TL;DR: 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine (CAS 109577-83-5) is a chemical compound with molecular formula C21H25ClN8 and molecular weight 424.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-amine
Also Known As: 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine, N-benzyl-6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-amine, 7-benzylamino-6-chloro-2-piperazino-4-pyrrolidino-pteridine, N-benzyl-6-chloro-2-(piperazin-1-yl)-4-(pyrrolidin-1-yl)pteridin-7-amine, N-Benzyl-6-chloro-2-piperazino-4-pyrrolizinopteridin-7-amine
| Molecular Formula | C21H25ClN8 |
|---|---|
| Molecular Weight | 424.19 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.18906 |
| Heavy Atoms | 30 |
| Complexity | 535.0 |
Chemical Identifiers
| CAS Number | 109577-83-5 |
|---|---|
| SMILES | C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CC=CC=C4)Cl)N5CCNCC5 |
| InChIKey | GEJPLNWGEJLXJN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine (CAS 109577-83-5), with molecular formula C21H25ClN8 and molecular weight 424.19 g/mol. IUPAC: N-benzyl-6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-amine.
Chemical Property Profile of 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine
Property Insights of 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine
The XLogP value of 3.3 indicates that 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine. Following Lipinski's Rule of Five, 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine has 2 hydrogen bond donor(s) and 8 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 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine?
The CAS number of 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine is 109577-83-5.
What is the molecular formula of 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine?
The molecular formula of 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine is C21H25ClN8.
What is the molecular weight of 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine?
The molecular weight of 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine is 424.19 g/mol.
Where can I buy 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine?
You can request a quote for 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine?
Yes, KEHONG BIO provides custom synthesis services for 7-Benzylamino-6-chloro-2-piperazino-4-pyrrolidinopteridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.