10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one

C17H12N2OS — CID 139804736

IUPAC10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one
SMILESCn1c2ccccc2c(=O)c2ccc(-c3nccs3)cc21
InChIInChI=1S/C17H12N2OS/c1-19-14-5-3-2-4-12(14)16(20)13-7-6-11(10-15(13)19)17-18-8-9-21-17/h2-10H,1H3
InChIKeyIAFYCPHHFHVWNG-UHFFFAOYSA-N
MW292.36 g/mol
LogP3.82
Rot. Bonds1

About 10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one

10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one (PubChem CID 139804736) has the molecular formula C17H12N2OS and a molecular weight of 292.36 g/mol. Its IUPAC name is 10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one.

Molecular Properties

Compound Name10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one
PubChem CID139804736
Molecular FormulaC17H12N2OS
Molecular Weight292.36 g/mol
Exact Mass292.07
IUPAC Name10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one
SMILESCn1c2ccccc2c(=O)c2ccc(-c3nccs3)cc21
InChIInChI=1S/C17H12N2OS/c1-19-14-5-3-2-4-12(14)16(20)13-7-6-11(10-15(13)19)17-18-8-9-21-17/h2-10H,1H3
InChIKeyIAFYCPHHFHVWNG-UHFFFAOYSA-N
XLogP3.82
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

5,12-dimethylquinolino[2,3-b]acridine-7,14-dione
CID 2844779
bicyclo[4.1.0]hepta-1,3,5-trien-7-one;2-(4-fluorophenyl)-1,3-thiazole
CID 174768764
3-(1,3-benzodioxol-5-yl)-10-methylacridin-9-one
CID 24818813
2-[3-[7-[3-(1,3-thiazol-2-yl)phenyl]triphenylen-2-yl]phenyl]-1,3-thiazole
CID 121297684
2-fluoro-10-methyl-6-thiophen-2-ylacridin-9-one
CID 139804633
10-methyl-2-phenylacridin-9-one
CID 18533849
8-methyl-8-azapentacyclo[20.4.0.02,7.09,14.015,20]hexacosa-1(26),2,4,6,9,11,13,15,17,19,22,24-dodecaen-21-one
CID 167125984
2-[4-(1,3-thiazol-2-yl)phenyl]-1,3-thiazole
CID 901538
9-methyl-2,7-dithiophen-2-ylcarbazole
CID 102153776
9-methyl-3-(9-methylcarbazol-2-yl)-6-phenylcarbazole;9-methyl-3-(9-methylcarbazol-3-yl)-6-phenylcarbazole;9-methyl-3-(9-methylcarbazol-3-yl)-6-(4-phenylphenyl)carbazole
CID 157228450
1-phenyl-5-(1,3-thiazol-2-yl)pyridin-2-one
CID 46853460
3-(3-methyl-2-oxobenzimidazol-1-yl)-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide
CID 16598987

Frequently Asked Questions

What is the IUPAC name of 10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one?
The IUPAC name of 10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one (CID 139804736) is 10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one.
What is the SMILES notation for 10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one?
The canonical SMILES for 10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one is Cn1c2ccccc2c(=O)c2ccc(-c3nccs3)cc21.
What is the InChIKey of 10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one?
The InChIKey is IAFYCPHHFHVWNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2OS/c1-19-14-5-3-2-4-12(14)16(20)13-7-6-11(10-15(13)19)17-18-8-9-21-17/h2-10H,1H3.
What are the key properties of 10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one?
10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one has a molecular weight of 292.36 g/mol, XLogP of 3.82, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one is sourced from PubChem (CID 139804736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).