BAS 12521203
TL;DR: BAS 12521203 (CAS 876899-03-5) is a chemical compound with molecular formula C23H29N5O3 and molecular weight 423.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimethyl-7-[(E)-3-phenylprop-2-enyl]purine-2,6-dione
Also Known As: BAS 12521203, F2582-0084, 7-cinnamyl-8-((2,6-dimethylmorpholino)methyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimethyl-7-[(E)-3-phenylprop-2-enyl]purine-2,6-dione, 7-((2E)-3-phenylprop-2-enyl)-8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimeth yl-1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C23H29N5O3 |
|---|---|
| Molecular Weight | 423.23 g/mol |
| LogP | 1.7563 |
| Topological Polar Surface Area | 74.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.22705 |
| Heavy Atoms | 31 |
| Complexity | 1211.9683 |
Chemical Identifiers
| CAS Number | 876899-03-5 |
|---|---|
| SMILES | CC1CN(CC(O1)C)CC2=NC3=C(N2C/C=C/C4=CC=CC=C4)C(=O)N(C(=O)N3C)C |
Product Overview
BAS 12521203 (CAS 876899-03-5), with molecular formula C23H29N5O3 and molecular weight 423.23 g/mol. IUPAC: 8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimethyl-7-[(E)-3-phenylprop-2-enyl]purine-2,6-dione.
Chemical Property Profile of BAS 12521203
Property Insights of BAS 12521203
The XLogP value of 1.7563 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12521203. The TPSA of 74.29 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12521203. Following Lipinski's Rule of Five, BAS 12521203 has 0 hydrogen bond donor(s) and 5 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 12521203?
The CAS number of BAS 12521203 is 876899-03-5.
What is the molecular formula of BAS 12521203?
The molecular formula of BAS 12521203 is C23H29N5O3.
What is the molecular weight of BAS 12521203?
The molecular weight of BAS 12521203 is 423.23 g/mol.
Where can I buy BAS 12521203?
You can request a quote for BAS 12521203 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12521203?
Yes, KEHONG BIO provides custom synthesis services for BAS 12521203 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.