AB00771255-01
TL;DR: AB00771255-01 (CAS 845662-91-1) is a chemical compound with molecular formula C23H30N6O2 and molecular weight 422.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-9-(4-methylphenyl)-3-(2-piperidin-1-ylethyl)-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Also Known As: AB00771255-01, F2013-0013, 1-methyl-9-(4-methylphenyl)-3-(2-piperidin-1-ylethyl)-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione, 1-methyl-3-(2-(piperidin-1-yl)ethyl)-9-(p-tolyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione, 1-methyl-9-(4-methylphenyl)-3-(2-piperidylethyl)-1,3,5-trihydro-6H,7H,8H-1,3-d iazaperhydroino[1,2-h]purine-2,4-dione
| Molecular Formula | C23H30N6O2 |
|---|---|
| Molecular Weight | 422.24 g/mol |
| LogP | 2.23282 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.243 |
| Heavy Atoms | 31 |
| Complexity | 1214.0681 |
Chemical Identifiers
| CAS Number | 845662-91-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2CCCN3C2=NC4=C3C(=O)N(C(=O)N4C)CCN5CCCCC5 |
Product Overview
AB00771255-01 (CAS 845662-91-1), with molecular formula C23H30N6O2 and molecular weight 422.24 g/mol. IUPAC: 1-methyl-9-(4-methylphenyl)-3-(2-piperidin-1-ylethyl)-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione.
Chemical Property Profile of AB00771255-01
Property Insights of AB00771255-01
The XLogP value of 2.23282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00771255-01. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00771255-01. Following Lipinski's Rule of Five, AB00771255-01 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 AB00771255-01?
The CAS number of AB00771255-01 is 845662-91-1.
What is the molecular formula of AB00771255-01?
The molecular formula of AB00771255-01 is C23H30N6O2.
What is the molecular weight of AB00771255-01?
The molecular weight of AB00771255-01 is 422.24 g/mol.
Where can I buy AB00771255-01?
You can request a quote for AB00771255-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00771255-01?
Yes, KEHONG BIO provides custom synthesis services for AB00771255-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.