2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene]

C36H24N2 — CID 129084873

IUPAC2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene]
SMILESc1ccc(-c2nc(-c3ccccc3)c3c(n2)C2(c4ccccc4C3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C36H24N2/c1-3-13-24(14-4-1)33-29-23-26-17-7-10-20-30(26)36(34(29)38-35(37-33)25-15-5-2-6-16-25)31-21-11-8-18-27(31)28-19-9-12-22-32(28)36/h1-22H,23H2
InChIKeySWSWUWQKIWPXHI-UHFFFAOYSA-N
MW484.60 g/mol
LogP8.08
Rot. Bonds2

About 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene]

2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene] (PubChem CID 129084873) has the molecular formula C36H24N2 and a molecular weight of 484.60 g/mol. Its IUPAC name is 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene].

Molecular Properties

Compound Name2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene]
PubChem CID129084873
Molecular FormulaC36H24N2
Molecular Weight484.60 g/mol
Exact Mass484.19
IUPAC Name2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene]
SMILESc1ccc(-c2nc(-c3ccccc3)c3c(n2)C2(c4ccccc4C3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C36H24N2/c1-3-13-24(14-4-1)33-29-23-26-17-7-10-20-30(26)36(34(29)38-35(37-33)25-15-5-2-6-16-25)31-21-11-8-18-27(31)28-19-9-12-22-32(28)36/h1-22H,23H2
InChIKeySWSWUWQKIWPXHI-UHFFFAOYSA-N
XLogP8.08
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.60
LogP ≤ 58.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene] with MolForge

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Related Compounds

2,4-diphenyl-5,10-dihydrobenzo[g]quinazoline
CID 101394728
2-(4-benzylphenyl)-2',4'-diphenylspiro[fluorene-9,9'-indeno[2,1-d]pyrimidine]
CID 129084913
2'-(4-bromophenyl)-4'-phenylspiro[fluorene-9,5'-indeno[1,2-d]pyrimidine]
CID 122551801
21-phenylspiro[20-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene-10,10'-9H-anthracene]
CID 164989189
8-bromo-2,4-diphenyl-5H-indeno[1,2-d]pyrimidine
CID 152936992
2-phenyl-4-[4-(4-phenylquinazolin-2-yl)phenyl]-5H-indeno[1,2-d]pyrimidine
CID 122487429
ethane;spiro[9H-anthracene-10,9'-fluorene]
CID 90717340
2-phenyl-4-[4-(9-phenylfluoren-9-yl)phenyl]-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 139521231
2-[4-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 139521317
2,4-diphenyl-6-[3-[8-(9,9'-spirobi[fluorene]-2-yl)-9H-fluoren-1-yl]phenyl]-1,3,5-triazine
CID 121241550
1-phenylpentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8,10,12(20),14,16,18-nonaene
CID 144907616
2-phenyl-4-(4-phenylphenyl)-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine
CID 129150894

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene]?
The IUPAC name of 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene] (CID 129084873) is 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene].
What is the SMILES notation for 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene]?
The canonical SMILES for 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene] is c1ccc(-c2nc(-c3ccccc3)c3c(n2)C2(c4ccccc4C3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene]?
The InChIKey is SWSWUWQKIWPXHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H24N2/c1-3-13-24(14-4-1)33-29-23-26-17-7-10-20-30(26)36(34(29)38-35(37-33)25-15-5-2-6-16-25)31-21-11-8-18-27(31)28-19-9-12-22-32(28)36/h1-22H,23H2.
What are the key properties of 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene]?
2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene] has a molecular weight of 484.60 g/mol, XLogP of 8.08, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenylspiro[5H-benzo[g]quinazoline-10,9'-fluorene] is sourced from PubChem (CID 129084873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).