AB01302788-01
TL;DR: AB01302788-01 (CAS 895850-48-3) is a chemical compound with molecular formula C21H22N4O3 and molecular weight 378.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-1-[(4-methoxyphenyl)methyl]-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: AB01302788-01, 6-benzyl-1-(4-methoxybenzyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 6-benzyl-2-hydroxy-1-(4-methoxybenzyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one, 6-benzyl-1-[(4-methoxyphenyl)methyl]-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione, 9-benzyl-5-[(4-methoxyphenyl)methyl]-3,5,7,9-tetrazabicyclo[4.4.0]dec-11-ene-2,4-dione
| Molecular Formula | C21H22N4O3 |
|---|---|
| Molecular Weight | 378.17 g/mol |
| LogP | 1.9787 |
| Topological Polar Surface Area | 79.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.1692 |
| Heavy Atoms | 28 |
| Complexity | 1071.545 |
Chemical Identifiers
| CAS Number | 895850-48-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2C3=C(CN(CN3)CC4=CC=CC=C4)C(=O)NC2=O |
Product Overview
AB01302788-01 (CAS 895850-48-3), with molecular formula C21H22N4O3 and molecular weight 378.17 g/mol. IUPAC: 6-benzyl-1-[(4-methoxyphenyl)methyl]-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of AB01302788-01
Property Insights of AB01302788-01
The XLogP value of 1.9787 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01302788-01. The TPSA of 79.36 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01302788-01. Following Lipinski's Rule of Five, AB01302788-01 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 AB01302788-01?
The CAS number of AB01302788-01 is 895850-48-3.
What is the molecular formula of AB01302788-01?
The molecular formula of AB01302788-01 is C21H22N4O3.
What is the molecular weight of AB01302788-01?
The molecular weight of AB01302788-01 is 378.17 g/mol.
Where can I buy AB01302788-01?
You can request a quote for AB01302788-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01302788-01?
Yes, KEHONG BIO provides custom synthesis services for AB01302788-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.