10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine

C34H26N2S — CID 102043530

IUPAC10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine
SMILESCN1c2ccccc2C(=Cc2ccc(C=C3c4ccccc4N(C)c4ccccc43)s2)c2ccccc21
InChIInChI=1S/C34H26N2S/c1-35-31-15-7-3-11-25(31)29(26-12-4-8-16-32(26)35)21-23-19-20-24(37-23)22-30-27-13-5-9-17-33(27)36(2)34-18-10-6-14-28(30)34/h3-22H,1-2H3
InChIKeyQHBINSKJYYDHND-UHFFFAOYSA-N
MW494.66 g/mol
LogP9.09
Rot. Bonds2

About 10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine

10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine (PubChem CID 102043530) has the molecular formula C34H26N2S and a molecular weight of 494.66 g/mol. Its IUPAC name is 10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine.

Molecular Properties

Compound Name10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine
PubChem CID102043530
Molecular FormulaC34H26N2S
Molecular Weight494.66 g/mol
Exact Mass494.18
IUPAC Name10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine
SMILESCN1c2ccccc2C(=Cc2ccc(C=C3c4ccccc4N(C)c4ccccc43)s2)c2ccccc21
InChIInChI=1S/C34H26N2S/c1-35-31-15-7-3-11-25(31)29(26-12-4-8-16-32(26)35)21-23-19-20-24(37-23)22-30-27-13-5-9-17-33(27)36(2)34-18-10-6-14-28(30)34/h3-22H,1-2H3
InChIKeyQHBINSKJYYDHND-UHFFFAOYSA-N
XLogP9.09
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.66
LogP ≤ 59.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethylidene-1-methylindol-2-one
CID 85157103
2-(10-methylacridin-9-ylidene)-1-phenylethanone
CID 3797236
3-[(4-fluorophenyl)methylidene]-1-methylindol-2-one
CID 964242
6-(3-hydroxyprop-2-enylidene)-11-methylbenzo[b][1]benzazepin-5-one
CID 173468506
(3E)-3-[(2-hydroxyphenyl)methylidene]-1-methylindol-2-one
CID 139193133
(3E)-1-methyl-3-propylideneindol-2-one
CID 58101344
1-methyl-3-[(4-phenylphenyl)methylidene]indol-2-one
CID 4209070
(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)methanamine
CID 57356776
(3Z)-3-[(5-ethylthiophen-2-yl)methylidene]-1-(2-methylpropyl)indol-2-one
CID 126115944
2-(2-methylphenyl)-4-[(5-methylthiophen-2-yl)methylidene]isoquinoline-1,3-dione
CID 4806074
2-(1-methyl-2-oxoindol-3-ylidene)acetyl chloride
CID 164576931
(10-methylacridin-9-ylidene)methoxy-oxo-phenoxyphosphanium
CID 18006786

Frequently Asked Questions

What is the IUPAC name of 10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine?
The IUPAC name of 10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine (CID 102043530) is 10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine.
What is the SMILES notation for 10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine?
The canonical SMILES for 10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine is CN1c2ccccc2C(=Cc2ccc(C=C3c4ccccc4N(C)c4ccccc43)s2)c2ccccc21.
What is the InChIKey of 10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine?
The InChIKey is QHBINSKJYYDHND-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26N2S/c1-35-31-15-7-3-11-25(31)29(26-12-4-8-16-32(26)35)21-23-19-20-24(37-23)22-30-27-13-5-9-17-33(27)36(2)34-18-10-6-14-28(30)34/h3-22H,1-2H3.
What are the key properties of 10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine?
10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine has a molecular weight of 494.66 g/mol, XLogP of 9.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-9-[[5-[(10-methylacridin-9-ylidene)methyl]thiophen-2-yl]methylidene]acridine is sourced from PubChem (CID 102043530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).