BAS 12663434
TL;DR: BAS 12663434 (CAS 878411-88-2) is a chemical compound with molecular formula C17H21N5O3 and molecular weight 343.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7,8-trimethyl-2-(3-oxobutan-2-yl)-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12663434, F2583-0727, 4,7,8-trimethyl-2-(3-oxobutan-2-yl)-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione, 8-allyl-1,6,7-trimethyl-3-(3-oxobutan-2-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
| Molecular Formula | C17H21N5O3 |
|---|---|
| Molecular Weight | 343.16 g/mol |
| LogP | 1.10224 |
| Topological Polar Surface Area | 83.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.16443 |
| Heavy Atoms | 25 |
| Complexity | 1155.5529 |
Chemical Identifiers
| CAS Number | 878411-88-2 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CC=C)N(C(=O)N(C3=O)C(C)C(=O)C)C)C |
Product Overview
BAS 12663434 (CAS 878411-88-2), with molecular formula C17H21N5O3 and molecular weight 343.16 g/mol. IUPAC: 4,7,8-trimethyl-2-(3-oxobutan-2-yl)-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 12663434
Property Insights of BAS 12663434
The XLogP value of 1.10224 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12663434. The TPSA of 83.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12663434. Following Lipinski's Rule of Five, BAS 12663434 has 0 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 12663434?
The CAS number of BAS 12663434 is 878411-88-2.
What is the molecular formula of BAS 12663434?
The molecular formula of BAS 12663434 is C17H21N5O3.
What is the molecular weight of BAS 12663434?
The molecular weight of BAS 12663434 is 343.16 g/mol.
Where can I buy BAS 12663434?
You can request a quote for BAS 12663434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12663434?
Yes, KEHONG BIO provides custom synthesis services for BAS 12663434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.