AB01281064-01
TL;DR: AB01281064-01 (CAS 861820-69-1) is a chemical compound with molecular formula C22H23N5O3 and molecular weight 405.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(4-methoxyphenyl)methylamino]-3-methyl-7-[(3-methylphenyl)methyl]purine-2,6-dione
Also Known As: AB01281064-01, 8-[(4-methoxyphenyl)methylamino]-3-methyl-7-[(3-methylphenyl)methyl]purine-2,6-dione, 8-[(4-METHOXYBENZYL)AMINO]-3-METHYL-7-(3-METHYLBENZYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE, 8-((4-methoxybenzyl)amino)-3-methyl-7-(3-methylbenzyl)-1H-purine-2,6(3H,7H)-dione, 8-{[(4-methoxyphenyl)methyl]amino}-3-methyl-7-[(3-methylphenyl)methyl]-1,3,7-t rihydropurine-2,6-dione
| Molecular Formula | C22H23N5O3 |
|---|---|
| Molecular Weight | 405.18 g/mol |
| LogP | 2.40072 |
| Topological Polar Surface Area | 93.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.18008 |
| Heavy Atoms | 30 |
| Complexity | 1315.5985 |
Chemical Identifiers
| CAS Number | 861820-69-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CN2C3=C(N=C2NCC4=CC=C(C=C4)OC)N(C(=O)NC3=O)C |
Product Overview
AB01281064-01 (CAS 861820-69-1), with molecular formula C22H23N5O3 and molecular weight 405.18 g/mol. IUPAC: 8-[(4-methoxyphenyl)methylamino]-3-methyl-7-[(3-methylphenyl)methyl]purine-2,6-dione.
Chemical Property Profile of AB01281064-01
Property Insights of AB01281064-01
The XLogP value of 2.40072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01281064-01. The TPSA of 93.94 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01281064-01. Following Lipinski's Rule of Five, AB01281064-01 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 AB01281064-01?
The CAS number of AB01281064-01 is 861820-69-1.
What is the molecular formula of AB01281064-01?
The molecular formula of AB01281064-01 is C22H23N5O3.
What is the molecular weight of AB01281064-01?
The molecular weight of AB01281064-01 is 405.18 g/mol.
Where can I buy AB01281064-01?
You can request a quote for AB01281064-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01281064-01?
Yes, KEHONG BIO provides custom synthesis services for AB01281064-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.