lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene

C24H21LiNO2P2+ — CID 59044615

IUPAClithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene
SMILESO=P(NP(=O)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[Li+]
InChIInChI=1S/C24H21NO2P2.Li/c26-28(21-13-5-1-6-14-21,22-15-7-2-8-16-22)25-29(27,23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H,(H,25,26,27);/q;+1
InChIKeyMGGBPTSLODEBSK-UHFFFAOYSA-N
MW424.33 g/mol
LogP1.44
Rot. Bonds6

About lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene

lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene (PubChem CID 59044615) has the molecular formula C24H21LiNO2P2+ and a molecular weight of 424.33 g/mol. Its IUPAC name is lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene.

Molecular Properties

Compound Namelithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene
PubChem CID59044615
Molecular FormulaC24H21LiNO2P2+
Molecular Weight424.33 g/mol
Exact Mass424.12
IUPAC Namelithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene
SMILESO=P(NP(=O)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[Li+]
InChIInChI=1S/C24H21NO2P2.Li/c26-28(21-13-5-1-6-14-21,22-15-7-2-8-16-22)25-29(27,23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H,(H,25,26,27);/q;+1
InChIKeyMGGBPTSLODEBSK-UHFFFAOYSA-N
XLogP1.44
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.33
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene with MolForge

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

Launch Full Analysis

Related Compounds

copper;bis([(diphenylphosphorylamino)-phenylphosphoryl]benzene)
CID 175947269
diphenylphosphorylbenzene;terbium
CID 86595283
lithium diphenylphosphinate
CID 23680317
4-N-diphenylphosphorylbenzene-1,4-diamine
CID 71676342
N-diphenylphosphoryl-4-fluoroaniline
CID 23234466
4-(diphenylphosphorylamino)phenol
CID 21072103
dichlorochromium;bis(diphenylphosphorylbenzene)
CID 23290734
diiodocobalt;bis(diphenylphosphorylbenzene)
CID 154702808
diphenylphosphorylbenzene;oxirene
CID 174881764
4-N-diphenylphosphoryl-1-N-[methyl(phenyl)phosphoryl]benzene-1,4-diamine
CID 71676353
diphenylphosphorylazanide
CID 18705552
N-diphenylphosphoryl-1-fluoren-9-ylidenemethanamine
CID 134933697

Frequently Asked Questions

What is the IUPAC name of lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene?
The IUPAC name of lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene (CID 59044615) is lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene.
What is the SMILES notation for lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene?
The canonical SMILES for lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene is O=P(NP(=O)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[Li+].
What is the InChIKey of lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene?
The InChIKey is MGGBPTSLODEBSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21NO2P2.Li/c26-28(21-13-5-1-6-14-21,22-15-7-2-8-16-22)25-29(27,23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H,(H,25,26,27);/q;+1.
What are the key properties of lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene?
lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene has a molecular weight of 424.33 g/mol, XLogP of 1.44, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium [(diphenylphosphorylamino)-phenylphosphoryl]benzene is sourced from PubChem (CID 59044615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).