波希米宁
TL;DR: 波希米宁 (CAS 189232-42-6) is a chemical compound with molecular formula C18H24N6O and molecular weight 340.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
波希米宁
3-[[6-(benzylamino)-9-propan-2-ylpurin-2-yl]amino]propan-1-ol
Also Known As: bohemine, Bohemin, purine deriv. 1, Bohemine?, 3-((6-(Benzylamino)-9-isopropyl-9H-purin-2-yl)amino)propan-1-ol
| Molecular Formula | C18H24N6O |
|---|---|
| Molecular Weight | 340.20 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 87.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 340.20117 |
| Heavy Atoms | 25 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 189232-42-6 |
|---|---|
| SMILES | CC(C)N1C=NC2=C(N=C(N=C21)NCCCO)NCC3=CC=CC=C3 |
| InChIKey | OPQGFIAVPSXOBO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
波希米宁 (CAS 189232-42-6), with molecular formula C18H24N6O and molecular weight 340.20 g/mol. IUPAC: 3-[[6-(benzylamino)-9-propan-2-ylpurin-2-yl]amino]propan-1-ol.
Chemical Property Profile of 波希米宁
Property Insights of 波希米宁
The XLogP value of 3.1 indicates that 波希米宁 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 波希米宁. Following Lipinski's Rule of Five, 波希米宁 has 3 hydrogen bond donor(s) and 6 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 波希米宁?
The CAS number of 波希米宁 is 189232-42-6.
What is the molecular formula of 波希米宁?
The molecular formula of 波希米宁 is C18H24N6O.
What is the molecular weight of 波希米宁?
The molecular weight of 波希米宁 is 340.20 g/mol.
Where can I buy 波希米宁?
You can request a quote for 波希米宁 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 波希米宁?
Yes, KEHONG BIO provides custom synthesis services for 波希米宁 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.