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trolnitratephosphate structure
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trolnitratephosphate

TL;DR: trolnitratephosphate (CAS 1020719-22-5) is a chemical compound with molecular formula C23H29N5O2 and molecular weight 407.23212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-butan-2-yl-4-[4-[4-(4-methoxyphenyl)piperazin-1-yl]phenyl]-1,2,4-triazol-3-one

Also Known As: trolnitratephosphate, Itraconazole EP Impurity A, Itraconazole Impurity A, Itraconazole impurity A [EP], TimTec1_006484

CAS Number
1020719-22-5
Molecular Formula
C23H29N5O2
Molecular Weight
407.23212 g/mol
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Technical Specifications

Molecular FormulaC23H29N5O2
Molecular Weight407.23212 g/mol
XLogP4.1
Topological Polar Surface Area (TPSA)51.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds6
Exact Mass407.23212 Da
Heavy Atoms30
Complexity590.0
SMILESCCC(C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC
InChIKeyIVIVGYTUQVJVPF-UHFFFAOYSA-N

Chemical Property Profile of trolnitratephosphate

XLogP
4.1
TPSA (Topological Polar Surface Area)
51.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
30
Complexity
590.0
Exact Mass
407.23212
Monoisotopic Mass
407.23212
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 trolnitratephosphate

The XLogP value of 4.1 indicates that trolnitratephosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.6 Ų, trolnitratephosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trolnitratephosphate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of trolnitratephosphate?

The CAS number of trolnitratephosphate is 1020719-22-5.

What is the molecular formula of trolnitratephosphate?

The molecular formula of trolnitratephosphate is C23H29N5O2.

What is the molecular weight of trolnitratephosphate?

The molecular weight of trolnitratephosphate is 407.23212 g/mol.

Where can I buy trolnitratephosphate?

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

Does CoreyChem offer custom synthesis for trolnitratephosphate?

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

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