![2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one structure](/static/products/895/895848-77-8.png)
2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
TL;DR: 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one (CAS 895848-77-8) is a chemical compound with molecular formula C17H22N4O3 and molecular weight 330.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-methoxyphenyl)methyl]-6-propan-2-yl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one, 6-isopropyl-1-(4-methoxybenzyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 1-[(4-methoxyphenyl)methyl]-6-propan-2-yl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione, 5-[(4-methoxyphenyl)methyl]-9-propan-2-yl-3,5,7,9-tetrazabicyclo[4.4.0]dec-11-ene-2,4-dione
| Molecular Formula | C17H22N4O3 |
|---|---|
| Molecular Weight | 330.17 g/mol |
| LogP | 1.1869 |
| Topological Polar Surface Area | 79.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.1692 |
| Heavy Atoms | 24 |
| Complexity | 836.39465 |
Chemical Identifiers
| CAS Number | 895848-77-8 |
|---|---|
| SMILES | CC(C)N1CC2=C(NC1)N(C(=O)NC2=O)CC3=CC=C(C=C3)OC |
Product Overview
2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one (CAS 895848-77-8), with molecular formula C17H22N4O3 and molecular weight 330.17 g/mol. IUPAC: 1-[(4-methoxyphenyl)methyl]-6-propan-2-yl-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Property Insights of 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
The XLogP value of 1.1869 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one. The TPSA of 79.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one. Following Lipinski's Rule of Five, 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one 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 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one?
The CAS number of 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one is 895848-77-8.
What is the molecular formula of 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one?
The molecular formula of 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one is C17H22N4O3.
What is the molecular weight of 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one?
The molecular weight of 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one is 330.17 g/mol.
Where can I buy 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one?
You can request a quote for 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-hydroxy-1-(4-methoxybenzyl)-6-(propan-2-yl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.