![8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one structure](/static/products/488/488724-08-9.png)
8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one
TL;DR: 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one (CAS 488724-08-9) is a chemical compound with molecular formula C28H33ClN4O2 and molecular weight 492.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one, (E)-8-chloro-3-((4-(decyloxy)benzylidene)amino)-2-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one, 8-chloro-3-({(E)-[4-(decyloxy)phenyl]methylidene}amino)-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C28H33ClN4O2 |
|---|---|
| Molecular Weight | 492.23 g/mol |
| LogP | 7.24132 |
| Topological Polar Surface Area | 72.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 492.22922 |
| Heavy Atoms | 35 |
| Complexity | 1355.6483 |
Chemical Identifiers
| CAS Number | 488724-08-9 |
|---|---|
| SMILES | CCCCCCCCCCOC1=CC=C(C=C1)/C=N/N2C(=NC3=C(C2=O)NC4=C3C=C(C=C4)Cl)C |
Product Overview
8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one (CAS 488724-08-9), with molecular formula C28H33ClN4O2 and molecular weight 492.23 g/mol. IUPAC: 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one
Property Insights of 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one
The XLogP value of 7.24132 indicates that 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one. Following Lipinski's Rule of Five, 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one?
The CAS number of 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one is 488724-08-9.
What is the molecular formula of 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one?
The molecular formula of 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one is C28H33ClN4O2.
What is the molecular weight of 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one?
The molecular weight of 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one is 492.23 g/mol.
Where can I buy 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one?
You can request a quote for 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 8-chloro-3-[(E)-(4-decoxyphenyl)methylideneamino]-2-methyl-5H-pyrimido[5,4-b]indol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.