BAS 00442349
TL;DR: BAS 00442349 (CAS 304875-16-9) is a chemical compound with molecular formula C15H24N6O2 and molecular weight 320.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(2E)-2-butan-2-ylidenehydrazinyl]-3-methyl-7-(3-methylbutyl)purine-2,6-dione
Also Known As: BAS 00442349, (E)-8-(2-(butan-2-ylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione, 8-[(2E)-2-butan-2-ylidenehydrazinyl]-3-methyl-7-(3-methylbutyl)purine-2,6-dione, 8-[((1E)-2-methyl-1-azabut-1-enyl)amino]-3-methyl-7-(3-methylbutyl)-1,3,7-trih ydropurine-2,6-dione, 8-[(2E)-2-(butan-2-ylidene)hydrazinyl]-6-hydroxy-3-methyl-7-(3-methylbutyl)-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C15H24N6O2 |
|---|---|
| Molecular Weight | 320.20 g/mol |
| LogP | 1.6672 |
| Topological Polar Surface Area | 97.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 320.19608 |
| Heavy Atoms | 23 |
| Complexity | 839.99475 |
Chemical Identifiers
| CAS Number | 304875-16-9 |
|---|---|
| SMILES | CC/C(=N/NC1=NC2=C(N1CCC(C)C)C(=O)NC(=O)N2C)/C |
Product Overview
BAS 00442349 (CAS 304875-16-9), with molecular formula C15H24N6O2 and molecular weight 320.20 g/mol. IUPAC: 8-[(2E)-2-butan-2-ylidenehydrazinyl]-3-methyl-7-(3-methylbutyl)purine-2,6-dione.
Chemical Property Profile of BAS 00442349
Property Insights of BAS 00442349
The XLogP value of 1.6672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00442349. The TPSA of 97.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00442349. Following Lipinski's Rule of Five, BAS 00442349 has 2 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 00442349?
The CAS number of BAS 00442349 is 304875-16-9.
What is the molecular formula of BAS 00442349?
The molecular formula of BAS 00442349 is C15H24N6O2.
What is the molecular weight of BAS 00442349?
The molecular weight of BAS 00442349 is 320.20 g/mol.
Where can I buy BAS 00442349?
You can request a quote for BAS 00442349 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00442349?
Yes, KEHONG BIO provides custom synthesis services for BAS 00442349 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.