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C25H28N4O2 structure
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C25H28N4O2

TL;DR: C25H28N4O2 (CAS 552285-09-3) is a chemical compound with molecular formula C25H28N4O2 and molecular weight 416.22122 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[(E)-[3-(4-tert-butylphenyl)-2-methylpropylidene]amino]-8-methoxy-5H-pyrimido[5,4-b]indol-4-one

Also Known As: (E)-3-((3-(4-(tert-butyl)phenyl)-2-methylpropylidene)amino)-8-methoxy-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-{[(1E)-3-(4-tert-butylphenyl)-2-methylpropylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

CAS Number
552285-09-3
Molecular Formula
C25H28N4O2
Molecular Weight
416.22122 g/mol
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Technical Specifications

Molecular FormulaC25H28N4O2
Molecular Weight416.22122 g/mol
XLogP5.4
Topological Polar Surface Area (TPSA)70.1 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds6
Exact Mass416.22122 Da
Heavy Atoms31
Complexity692.0
SMILESCC(CC1=CC=C(C=C1)C(C)(C)C)/C=N/N2C=NC3=C(C2=O)NC4=C3C=C(C=C4)OC
InChIKeyUCXWKCOYRLZGAS-MZJWZYIUSA-N

Chemical Property Profile of C25H28N4O2

XLogP
5.4
TPSA (Topological Polar Surface Area)
70.1
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
6
Heavy Atoms
31
Complexity
692.0
Exact Mass
416.22122
Monoisotopic Mass
416.22122
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 C25H28N4O2

The XLogP value of 5.4 indicates that C25H28N4O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H28N4O2. Following Lipinski's Rule of Five, C25H28N4O2 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of C25H28N4O2?

The CAS number of C25H28N4O2 is 552285-09-3.

What is the molecular formula of C25H28N4O2?

The molecular formula of C25H28N4O2 is C25H28N4O2.

What is the molecular weight of C25H28N4O2?

The molecular weight of C25H28N4O2 is 416.22122 g/mol.

Where can I buy C25H28N4O2?

You can request a quote for C25H28N4O2 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for C25H28N4O2?

Yes, CoreyChem provides custom synthesis services for C25H28N4O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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