![6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione structure](/static/products/859/859666-52-7.png)
6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione
TL;DR: 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione (CAS 859666-52-7) is a chemical compound with molecular formula C23H22N4O4 and molecular weight 418.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-1-[(4-methoxyphenyl)methyl]-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4-dione
Also Known As: 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione, 2,6-dihydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)pyrimidin-4(3H)-one, 6-hydroxy-1-[(4-methoxyphenyl)methyl]-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4-dione
| Molecular Formula | C23H22N4O4 |
|---|---|
| Molecular Weight | 418.16 g/mol |
| LogP | 2.0155 |
| Topological Polar Surface Area | 112.14 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 418.1641 |
| Heavy Atoms | 31 |
| Complexity | 1381.7117 |
Chemical Identifiers
| CAS Number | 859666-52-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2C(=C(C(=O)NC2=O)C3C4=C(CCN3)C5=CC=CC=C5N4)O |
Product Overview
6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione (CAS 859666-52-7), with molecular formula C23H22N4O4 and molecular weight 418.16 g/mol. IUPAC: 6-hydroxy-1-[(4-methoxyphenyl)methyl]-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4-dione.
Chemical Property Profile of 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione
Property Insights of 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione
The XLogP value of 2.0155 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione. The TPSA of 112.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione has 4 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 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione?
The CAS number of 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione is 859666-52-7.
What is the molecular formula of 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione is C23H22N4O4.
What is the molecular weight of 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione is 418.16 g/mol.
Where can I buy 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-hydroxy-3-(4-methoxybenzyl)-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.