trolnitratephosphate
TL;DR: trolnitratephosphate (CAS 1020719-22-5) is a chemical compound with molecular formula C23H29N5O2 and molecular weight 407.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C23H29N5O2 |
|---|---|
| Molecular Weight | 407.23 g/mol |
| LogP | 3.3402 |
| Topological Polar Surface Area | 55.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.23212 |
| Heavy Atoms | 30 |
| Complexity | 1014.9971 |
Chemical Identifiers
| CAS Number | 1020719-22-5 |
|---|---|
| SMILES | CCC(C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC |
Product Overview
trolnitratephosphate (CAS 1020719-22-5), with molecular formula C23H29N5O2 and molecular weight 407.23 g/mol. IUPAC: 2-butan-2-yl-4-[4-[4-(4-methoxyphenyl)piperazin-1-yl]phenyl]-1,2,4-triazol-3-one.
Chemical Property Profile of trolnitratephosphate
Property Insights of trolnitratephosphate
The XLogP value of 3.3402 indicates that trolnitratephosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.53 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
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 407.23 g/mol.
Where can I buy trolnitratephosphate?
You can request a quote for trolnitratephosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trolnitratephosphate?
Yes, KEHONG BIO provides custom synthesis services for trolnitratephosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.