2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one

C24H20N4O — CID 136825596

IUPAC2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one
SMILESCc1ccc2c(c1)C1=Nc3ccccc3CN1C1(N2)C(=O)Nc2ccc(C)cc21
InChIInChI=1S/C24H20N4O/c1-14-7-9-20-17(11-14)22-25-19-6-4-3-5-16(19)13-28(22)24(27-20)18-12-15(2)8-10-21(18)26-23(24)29/h3-12,27H,13H2,1-2H3,(H,26,29)
InChIKeyNLZALBYTZXDEDI-UHFFFAOYSA-N
MW380.45 g/mol
LogP4.43
Rot. Bonds

About 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one

2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one (PubChem CID 136825596) has the molecular formula C24H20N4O and a molecular weight of 380.45 g/mol. Its IUPAC name is 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one.

Molecular Properties

Compound Name2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one
PubChem CID136825596
Molecular FormulaC24H20N4O
Molecular Weight380.45 g/mol
Exact Mass380.16
IUPAC Name2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one
SMILESCc1ccc2c(c1)C1=Nc3ccccc3CN1C1(N2)C(=O)Nc2ccc(C)cc21
InChIInChI=1S/C24H20N4O/c1-14-7-9-20-17(11-14)22-25-19-6-4-3-5-16(19)13-28(22)24(27-20)18-12-15(2)8-10-21(18)26-23(24)29/h3-12,27H,13H2,1-2H3,(H,26,29)
InChIKeyNLZALBYTZXDEDI-UHFFFAOYSA-N
XLogP4.43
TPSA56.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one with MolForge

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Related Compounds

5-methyl-3'-prop-2-enylspiro[1H-indole-3,2'-1H-quinazoline]-2,4'-dione
CID 78788427
9-methyl-10b-phenyl-1,2,3,6-tetrahydroimidazo[1,2-c]quinazolin-5-one
CID 67812642
2-methyl-11,13-dihydro-6H-quinazolino[2,3-b]quinazoline
CID 10083413
8-methyl-5,11-dihydrobenzo[c][1]benzazepin-6-one
CID 102431030
5-methylspiro[1H-indole-3,2'-3H-1,3-benzothiazole]-2-one
CID 45275938
6-(1,4-diazepan-1-yl)-8-methyl-11H-benzo[b][1,4]benzodiazepine;ethane;methoxyethane
CID 142859800
(3S)-1',1'-dichloro-5-methylspiro[1H-indole-3,2'-cyclopropane]-2-one
CID 175639660
2-(4-methylphenyl)-3-phenyl-4H-quinazoline
CID 174881000
methyl 5,6'-dimethyl-2-oxospiro[1H-indole-3,2'-1H-quinazoline]-4'-carboxylate
CID 167108795
5'-methyl-2-[3-methyl-5-[(E)-2-phenylethenyl]-1,2-oxazol-4-yl]spiro[1H-benzo[f]isoindole-3,3'-1H-indole]-2',4,9-trione
CID 71682830
5-fluorospiro[1H-indole-3,6'-5H-benzimidazolo[1,2-c]quinazoline]-2-one
CID 4224608
2-(2,5-dimethylphenyl)-3H-indole
CID 118351581

Frequently Asked Questions

What is the IUPAC name of 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one?
The IUPAC name of 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one (CID 136825596) is 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one.
What is the SMILES notation for 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one?
The canonical SMILES for 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one is Cc1ccc2c(c1)C1=Nc3ccccc3CN1C1(N2)C(=O)Nc2ccc(C)cc21.
What is the InChIKey of 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one?
The InChIKey is NLZALBYTZXDEDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O/c1-14-7-9-20-17(11-14)22-25-19-6-4-3-5-16(19)13-28(22)24(27-20)18-12-15(2)8-10-21(18)26-23(24)29/h3-12,27H,13H2,1-2H3,(H,26,29).
What are the key properties of 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one?
2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one has a molecular weight of 380.45 g/mol, XLogP of 4.43, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2',5-dimethylspiro[1H-indole-3,6'-5,8-dihydroquinazolino[3,2-c]quinazoline]-2-one is sourced from PubChem (CID 136825596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).