triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane

C23H25Cl4N5P4 — CID 13418976

IUPACtriphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane
SMILESClP1(Cl)=NP(Cl)(Cl)=NP(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)(N2CCCCC2)=N1
InChIInChI=1S/C23H25Cl4N5P4/c24-34(25)29-35(26,27)31-36(30-34,32-19-11-4-12-20-32)28-33(21-13-5-1-6-14-21,22-15-7-2-8-16-22)23-17-9-3-10-18-23/h1-3,5-10,13-18H,4,11-12,19-20H2
InChIKeyFKXHSDKORGGDAU-UHFFFAOYSA-N
MW637.20 g/mol
LogP10.46
Rot. Bonds5

About triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane

triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane (PubChem CID 13418976) has the molecular formula C23H25Cl4N5P4 and a molecular weight of 637.20 g/mol. Its IUPAC name is triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane.

Molecular Properties

Compound Nametriphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane
PubChem CID13418976
Molecular FormulaC23H25Cl4N5P4
Molecular Weight637.20 g/mol
Exact Mass634.98
IUPAC Nametriphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane
SMILESClP1(Cl)=NP(Cl)(Cl)=NP(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)(N2CCCCC2)=N1
InChIInChI=1S/C23H25Cl4N5P4/c24-34(25)29-35(26,27)31-36(30-34,32-19-11-4-12-20-32)28-33(21-13-5-1-6-14-21,22-15-7-2-8-16-22)23-17-9-3-10-18-23/h1-3,5-10,13-18H,4,11-12,19-20H2
InChIKeyFKXHSDKORGGDAU-UHFFFAOYSA-N
XLogP10.46
TPSA52.68 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500637.20
LogP ≤ 510.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane?
The IUPAC name of triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane (CID 13418976) is triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane.
What is the SMILES notation for triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane?
The canonical SMILES for triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane is ClP1(Cl)=NP(Cl)(Cl)=NP(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)(N2CCCCC2)=N1.
What is the InChIKey of triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane?
The InChIKey is FKXHSDKORGGDAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25Cl4N5P4/c24-34(25)29-35(26,27)31-36(30-34,32-19-11-4-12-20-32)28-33(21-13-5-1-6-14-21,22-15-7-2-8-16-22)23-17-9-3-10-18-23/h1-3,5-10,13-18H,4,11-12,19-20H2.
What are the key properties of triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane?
triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane has a molecular weight of 637.20 g/mol, XLogP of 10.46, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[(4,4,6,6-tetrachloro-2-piperidin-1-yl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-trien-2-yl)imino]-lambda5-phosphane is sourced from PubChem (CID 13418976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).