BAS 12662718
TL;DR: BAS 12662718 (CAS 878718-82-2) is a chemical compound with molecular formula C19H18ClN5O4 and molecular weight 415.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(5-chloro-2-methoxyphenyl)-4,7-dimethyl-2-(2-oxopropyl)purino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12662718, F2583-0290, 6-(5-chloro-2-methoxyphenyl)-4,7-dimethyl-2-(2-oxopropyl)purino[7,8-a]imidazole-1,3-dione, 8-(5-chloro-2-methoxyphenyl)-1,7-dimethyl-3-(2-oxopropyl)-1,3,5-trihydro-4-imi dazolino[1,2-h]purine-2,4-dione, 8-(5-chloro-2-methoxyphenyl)-1,7-dimethyl-3-(2-oxopropyl)-1H,2H,3H,4H,8H-imidazo[1,2-g]purine-2,4-dione
| Molecular Formula | C19H18ClN5O4 |
|---|---|
| Molecular Weight | 415.10 g/mol |
| LogP | 1.69802 |
| Topological Polar Surface Area | 92.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 415.10474 |
| Heavy Atoms | 29 |
| Complexity | 1422.8938 |
Chemical Identifiers
| CAS Number | 878718-82-2 |
|---|---|
| SMILES | CC1=CN2C3=C(N=C2N1C4=C(C=CC(=C4)Cl)OC)N(C(=O)N(C3=O)CC(=O)C)C |
Product Overview
BAS 12662718 (CAS 878718-82-2), with molecular formula C19H18ClN5O4 and molecular weight 415.10 g/mol. IUPAC: 6-(5-chloro-2-methoxyphenyl)-4,7-dimethyl-2-(2-oxopropyl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 12662718
Property Insights of BAS 12662718
The XLogP value of 1.69802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12662718. The TPSA of 92.53 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12662718. Following Lipinski's Rule of Five, BAS 12662718 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 12662718?
The CAS number of BAS 12662718 is 878718-82-2.
What is the molecular formula of BAS 12662718?
The molecular formula of BAS 12662718 is C19H18ClN5O4.
What is the molecular weight of BAS 12662718?
The molecular weight of BAS 12662718 is 415.10 g/mol.
Where can I buy BAS 12662718?
You can request a quote for BAS 12662718 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12662718?
Yes, KEHONG BIO provides custom synthesis services for BAS 12662718 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.