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ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate structure
Fine Chemical

ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate

TL;DR: ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate (CAS 1185148-14-4) is a chemical compound with molecular formula C25H24N4O6 and molecular weight 476.1696 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

ethyl 4-[6-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,4-dioxopyrimidin-1-yl]benzoate

Also Known As: ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate, ethyl 4-[2,4-dihydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-6-oxopyrimidin-1(6H)-yl]benzoate, ethyl 4-[6-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,4-dioxopyrimidin-1-yl]benzoate

CAS Number
1185148-14-4
Molecular Formula
C25H24N4O6
Molecular Weight
476.1696 g/mol
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Technical Specifications

Molecular FormulaC25H24N4O6
Molecular Weight476.1696 g/mol
XLogP2.1
Topological Polar Surface Area (TPSA)133.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors7
Rotatable Bonds6
Exact Mass476.1696 Da
Heavy Atoms35
Complexity885.0
SMILESCCOC(=O)C1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)C3C4=C(CCN3)C5=C(N4)C=CC(=C5)OC)O
InChIKeyNBAXUOYDLQPDMW-UHFFFAOYSA-N

Chemical Property Profile of ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate

XLogP
2.1
TPSA (Topological Polar Surface Area)
133.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
7
Rotatable Bonds
6
Heavy Atoms
35
Complexity
885.0
Exact Mass
476.1696
Monoisotopic Mass
476.1696
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate

The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate. Following Lipinski's Rule of Five, ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate?

The CAS number of ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate is 1185148-14-4.

What is the molecular formula of ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate?

The molecular formula of ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate is C25H24N4O6.

What is the molecular weight of ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate?

The molecular weight of ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate is 476.1696 g/mol.

Where can I buy ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate?

You can request a quote for ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate?

Yes, CoreyChem provides custom synthesis services for ethyl 4-(4-hydroxy-5-(6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2,6-dioxo-2,3-dihydropyrimidin-1(6H)-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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