CID 146184593

C50H32N2O — CID 146184593

IUPAC—
SMILESC1=Cc2ccc3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5C5(c6ccccc6Oc6ccccc65)c5ccccc54)nc3c2NC1
InChIInChI=1S/C50H32N2O/c1-2-16-35-33(14-1)46-34(43-29-28-32-27-26-31-13-12-30-51-47(31)48(32)52-43)15-11-23-42(46)49(35)36-17-3-5-19-38(36)50(39-20-6-4-18-37(39)49)40-21-7-9-24-44(40)53-45-25-10-8-22-41(45)50/h1-29,51H,30H2
InChIKeyDFLLKDVXGLFSEA-UHFFFAOYSA-N
MW676.82 g/mol
LogP11.51
Rot. Bonds1

About CID 146184593

CID 146184593 (PubChem CID 146184593) has the molecular formula C50H32N2O and a molecular weight of 676.82 g/mol.

Molecular Properties

Compound NameCID 146184593
PubChem CID146184593
Molecular FormulaC50H32N2O
Molecular Weight676.82 g/mol
Exact Mass676.25
IUPAC Name—
SMILESC1=Cc2ccc3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5C5(c6ccccc6Oc6ccccc65)c5ccccc54)nc3c2NC1
InChIInChI=1S/C50H32N2O/c1-2-16-35-33(14-1)46-34(43-29-28-32-27-26-31-13-12-30-51-47(31)48(32)52-43)15-11-23-42(46)49(35)36-17-3-5-19-38(36)50(39-20-6-4-18-37(39)49)40-21-7-9-24-44(40)53-45-25-10-8-22-41(45)50/h1-29,51H,30H2
InChIKeyDFLLKDVXGLFSEA-UHFFFAOYSA-N
XLogP11.51
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500676.82
LogP ≤ 511.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze CID 146184593 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

9-[3-(5,11,11-triphenylbenzo[b]fluoren-2-yl)phenyl]-1,2-dihydro-1,10-phenanthroline
CID 170411869
4-phenyl-2-(3-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-4-ylpyrimidine
CID 146661051
2-phenyl-4-(4-phenylphenyl)-6-(4-spiro[fluorene-9,9'-xanthene]-4-ylphenyl)-1,3,5-triazine
CID 146326888
4-(4-naphthalen-2-ylphenyl)-6-phenyl-2-spiro[fluorene-9,9'-xanthene]-4-ylpyrimidine
CID 158505780
2-phenyl-4-(3-phenylphenyl)-6-(3-spiro[fluorene-9,9'-xanthene]-4-ylphenyl)-1,3,5-triazine
CID 146326904
2-naphthalen-2-yl-4-(7-pyridin-2-ylnaphthalen-2-yl)-6-spiro[fluorene-9,9'-xanthene]-4-yl-1,3,5-triazine
CID 147850051
9,9-diphenyl-2-(9,9'-spirobi[fluorene]-4'-yl)xanthene
CID 170017230
2'-(9,9-diphenylfluoren-4-yl)spiro[fluorene-9,9'-xanthene]
CID 170018800
2-spiro[benzo[c]fluorene-7,9'-fluorene]-4'-ylspiro[fluorene-9,9'-xanthene]
CID 177126728
4-(4-phenanthren-9-ylphenyl)-2-phenyl-6-spiro[fluorene-9,9'-xanthene]-4-ylpyrimidine
CID 161372261
2-[9,9-diphenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-1-yl]-1,10-phenanthroline
CID 142453578
3-[4-(9-spiro[fluorene-9,9'-xanthene]-3'-yl-1,10-phenanthrolin-4-yl)spiro[fluorene-9,9'-xanthene]-3'-yl]benzonitrile
CID 155476623

Frequently Asked Questions

What is the IUPAC name of CID 146184593?
The IUPAC name of CID 146184593 (CID 146184593) is not available.
What is the SMILES notation for CID 146184593?
The canonical SMILES for CID 146184593 is C1=Cc2ccc3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5C5(c6ccccc6Oc6ccccc65)c5ccccc54)nc3c2NC1.
What is the InChIKey of CID 146184593?
The InChIKey is DFLLKDVXGLFSEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H32N2O/c1-2-16-35-33(14-1)46-34(43-29-28-32-27-26-31-13-12-30-51-47(31)48(32)52-43)15-11-23-42(46)49(35)36-17-3-5-19-38(36)50(39-20-6-4-18-37(39)49)40-21-7-9-24-44(40)53-45-25-10-8-22-41(45)50/h1-29,51H,30H2.
What are the key properties of CID 146184593?
CID 146184593 has a molecular weight of 676.82 g/mol, XLogP of 11.51, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 146184593 is sourced from PubChem (CID 146184593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).