BAS 12663431
TL;DR: BAS 12663431 (CAS 878411-79-1) is a chemical compound with molecular formula C19H26N6O3 and molecular weight 386.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7,8-trimethyl-2-(2-morpholin-4-ylethyl)-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12663431, F2583-0724, 4,7,8-trimethyl-2-(2-morpholin-4-ylethyl)-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione, 8-allyl-1,6,7-trimethyl-3-(2-morpholinoethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 1,6,7-trimethyl-3-(2-morpholin-4-ylethyl)-8-prop-2-enyl-1,3,5-trihydro-4-imida zolino[1,2-h]purine-2,4-dione
| Molecular Formula | C19H26N6O3 |
|---|---|
| Molecular Weight | 386.21 g/mol |
| LogP | 0.28444 |
| Topological Polar Surface Area | 78.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.20663 |
| Heavy Atoms | 28 |
| Complexity | 1172.8944 |
Chemical Identifiers
| CAS Number | 878411-79-1 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CC=C)N(C(=O)N(C3=O)CCN4CCOCC4)C)C |
Product Overview
BAS 12663431 (CAS 878411-79-1), with molecular formula C19H26N6O3 and molecular weight 386.21 g/mol. IUPAC: 4,7,8-trimethyl-2-(2-morpholin-4-ylethyl)-6-prop-2-enylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 12663431
Property Insights of BAS 12663431
The XLogP value of 0.28444 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12663431. The TPSA of 78.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12663431. Following Lipinski's Rule of Five, BAS 12663431 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 12663431?
The CAS number of BAS 12663431 is 878411-79-1.
What is the molecular formula of BAS 12663431?
The molecular formula of BAS 12663431 is C19H26N6O3.
What is the molecular weight of BAS 12663431?
The molecular weight of BAS 12663431 is 386.21 g/mol.
Where can I buy BAS 12663431?
You can request a quote for BAS 12663431 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12663431?
Yes, KEHONG BIO provides custom synthesis services for BAS 12663431 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.