![(E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one structure](/static/products/371/371945-75-4.png)
(E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one
TL;DR: (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 371945-75-4) is a chemical compound with molecular formula C20H18N4O3 and molecular weight 362.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-8-methyl-5H-pyrimido[5,4-b]indol-4-one
Also Known As: (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-8-methyl-5H-pyrimido[5,4-b]indol-4-one, 3-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C20H18N4O3 |
|---|---|
| Molecular Weight | 362.14 g/mol |
| LogP | 3.08562 |
| Topological Polar Surface Area | 81.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.13788 |
| Heavy Atoms | 27 |
| Complexity | 1237.4169 |
Chemical Identifiers
| CAS Number | 371945-75-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)/N=C/C4=CC(=C(C=C4)OC)OC |
Product Overview
(E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 371945-75-4), with molecular formula C20H18N4O3 and molecular weight 362.14 g/mol. IUPAC: 3-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-8-methyl-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one
Property Insights of (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one
The XLogP value of 3.08562 indicates that (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one. Following Lipinski's Rule of Five, (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one has 1 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 (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one?
The CAS number of (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one is 371945-75-4.
What is the molecular formula of (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular formula of (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one is C20H18N4O3.
What is the molecular weight of (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular weight of (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one is 362.14 g/mol.
Where can I buy (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one?
You can request a quote for (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-((3,4-dimethoxybenzylidene)amino)-8-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.