![3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione structure](/static/products/859/859669-57-1.png)
3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione
TL;DR: 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione (CAS 859669-57-1) is a chemical compound with molecular formula C20H24N4O3 and molecular weight 368.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-6-hydroxy-5-(2-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl)pyrimidine-2,4-dione
Also Known As: 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione, 1-tert-butyl-6-hydroxy-5-(2-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl)pyrimidine-2,4-dione, 3-tert-butyl-2,6-dihydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)pyrimidin-4(3H)-one
| Molecular Formula | C20H24N4O3 |
|---|---|
| Molecular Weight | 368.18 g/mol |
| LogP | 2.0558 |
| Topological Polar Surface Area | 94.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 368.18484 |
| Heavy Atoms | 27 |
| Complexity | 1146.714 |
Chemical Identifiers
| CAS Number | 859669-57-1 |
|---|---|
| SMILES | CC(C)(C)N1C(=C(C(=O)NC1=O)C2C3=C(CCN2C)C4=CC=CC=C4N3)O |
Product Overview
3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione (CAS 859669-57-1), with molecular formula C20H24N4O3 and molecular weight 368.18 g/mol. IUPAC: 1-tert-butyl-6-hydroxy-5-(2-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl)pyrimidine-2,4-dione.
Chemical Property Profile of 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione
Property Insights of 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione
The XLogP value of 2.0558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione. The TPSA of 94.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(tert-butyl)-6-hydroxy-5-(2-methyl-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, 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione has 3 hydrogen bond donor(s) and 4 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 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione?
The CAS number of 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione is 859669-57-1.
What is the molecular formula of 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione is C20H24N4O3.
What is the molecular weight of 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 3-(tert-butyl)-6-hydroxy-5-(2-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidine-2,4(1H,3H)-dione is 368.18 g/mol.
Where can I buy 3-(tert-butyl)-6-hydroxy-5-(2-methyl-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 3-(tert-butyl)-6-hydroxy-5-(2-methyl-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 3-(tert-butyl)-6-hydroxy-5-(2-methyl-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 3-(tert-butyl)-6-hydroxy-5-(2-methyl-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.