BAS 00619055
TL;DR: BAS 00619055 (CAS 331839-90-8) is a chemical compound with molecular formula C24H24N6O4 and molecular weight 460.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-[(2E)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]purine-2,6-dione
Also Known As: BAS 00619055, 7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-{(2E)-2-[(2E)-3-phenylprop-2-en-1-ylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione, 7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-((E)-2-((E)-3-phenylallylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione, 8-[((1E,3E)-4-phenyl-1-azabuta-1,3-dienyl)amino]-7-(2-hydroxy-3-phenoxypropyl) -3-methyl-1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C24H24N6O4 |
|---|---|
| Molecular Weight | 460.19 g/mol |
| LogP | 1.9743 |
| Topological Polar Surface Area | 126.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 460.1859 |
| Heavy Atoms | 34 |
| Complexity | 1421.1232 |
Chemical Identifiers
| CAS Number | 331839-90-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)N/N=C/C=C/C3=CC=CC=C3)CC(COC4=CC=CC=C4)O |
Product Overview
BAS 00619055 (CAS 331839-90-8), with molecular formula C24H24N6O4 and molecular weight 460.19 g/mol. IUPAC: 7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-[(2E)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]purine-2,6-dione.
Chemical Property Profile of BAS 00619055
Property Insights of BAS 00619055
The XLogP value of 1.9743 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00619055. The TPSA of 126.53 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00619055. Following Lipinski's Rule of Five, BAS 00619055 has 3 hydrogen bond donor(s) and 7 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 00619055?
The CAS number of BAS 00619055 is 331839-90-8.
What is the molecular formula of BAS 00619055?
The molecular formula of BAS 00619055 is C24H24N6O4.
What is the molecular weight of BAS 00619055?
The molecular weight of BAS 00619055 is 460.19 g/mol.
Where can I buy BAS 00619055?
You can request a quote for BAS 00619055 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00619055?
Yes, KEHONG BIO provides custom synthesis services for BAS 00619055 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.