![1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one structure](/static/products/118/1185155-36-5.webp)
1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
TL;DR: 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one (CAS 1185155-36-5) is a chemical compound with molecular formula C23H22N4O2S and molecular weight 418.14636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,5-dimethylphenyl)-6-hydroxy-2-sulfanylidene-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidin-4-one
Also Known As: 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one, 3-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one, 1-(2,5-dimethylphenyl)-6-hydroxy-2-sulfanyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)pyrimidin-4(1H)-one, 1-(2,5-dimethylphenyl)-6-hydroxy-2-sulfanylidene-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidin-4-one
Technical Specifications
| Molecular Formula | C23H22N4O2S |
| Molecular Weight | 418.14636 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 418.14636 Da |
| Heavy Atoms | 30 |
| Complexity | 755.0 |
| SMILES | CC1=CC(=C(C=C1)C)N2C(=C(C(=O)NC2=S)C3C4=C(CCN3)C5=CC=CC=C5N4)O |
| InChIKey | XRSGGQWLJFXQJB-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Property Insights of 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
The XLogP value of 3.2 indicates that 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one. Following Lipinski's Rule of Five, 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
The CAS number of 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is 1185155-36-5.
What is the molecular formula of 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
The molecular formula of 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is C23H22N4O2S.
What is the molecular weight of 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
The molecular weight of 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one is 418.14636 g/mol.
Where can I buy 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
You can request a quote for 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one?
Yes, CoreyChem provides custom synthesis services for 1-(2,5-dimethylphenyl)-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.