BAS 06502908
TL;DR: BAS 06502908 (CAS 478252-94-7) is a chemical compound with molecular formula C18H20ClN5O2 and molecular weight 373.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(benzylamino)-7-(3-chlorobut-2-enyl)-1,3-dimethylpurine-2,6-dione
Also Known As: BAS 06502908, 8-(benzylamino)-7-(3-chlorobut-2-enyl)-1,3-dimethylpurine-2,6-dione, 8-(Benzylamino)-7-(3-chlorobut-2-en-1-yl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 8-(benzylamino)-7-[(2Z)-3-chlorobut-2-en-1-yl]-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C18H20ClN5O2 |
|---|---|
| Molecular Weight | 373.13 g/mol |
| LogP | 2.1884 |
| Topological Polar Surface Area | 73.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.13055 |
| Heavy Atoms | 26 |
| Complexity | 1088.6974 |
Chemical Identifiers
| CAS Number | 478252-94-7 |
|---|---|
| SMILES | CC(=CCN1C2=C(N=C1NCC3=CC=CC=C3)N(C(=O)N(C2=O)C)C)Cl |
Product Overview
BAS 06502908 (CAS 478252-94-7), with molecular formula C18H20ClN5O2 and molecular weight 373.13 g/mol. IUPAC: 8-(benzylamino)-7-(3-chlorobut-2-enyl)-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of BAS 06502908
Property Insights of BAS 06502908
The XLogP value of 2.1884 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06502908. The TPSA of 73.85 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06502908. Following Lipinski's Rule of Five, BAS 06502908 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 BAS 06502908?
The CAS number of BAS 06502908 is 478252-94-7.
What is the molecular formula of BAS 06502908?
The molecular formula of BAS 06502908 is C18H20ClN5O2.
What is the molecular weight of BAS 06502908?
The molecular weight of BAS 06502908 is 373.13 g/mol.
Where can I buy BAS 06502908?
You can request a quote for BAS 06502908 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06502908?
Yes, KEHONG BIO provides custom synthesis services for BAS 06502908 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.