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N-(8-PHENYL-4,5-DIHYDRO-THIAZOLO[4,5-h]QUINAZOLIN-2-YL)-PROPIONIC ACID AMIDE

HCID 57741208
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCC(=O)Nc1nc2c(s1)-c1nc(-c3ccccc3)ncc1CC2
InChIKey
DZSWNZMHNZUWCQ-UHFFFAOYSA-N
Molecular formula
C18H16N4OS
Average molar mass
336.4 g/mol
Monoisotopic mass
336.10448232

Names & identifiers

Preferred name
N-(8-PHENYL-4,5-DIHYDRO-THIAZOLO[4,5-h]QUINAZOLIN-2-YL)-PROPIONIC ACID AMIDE
IUPAC
N-(8-phenyl-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-2-yl)propanamide

Names & synonyms

SCHEMBL11942176DZSWNZMHNZUWCQ-UHFFFAOYSA-NN-(8-PHENYL-4,5-DIHYDRO-THIAZOLO[4,5-h]QUINAZOLIN-2-YL)-PROPIONIC ACID AMIDE

Database identifiers

PubChem CID
57741208

Properties

Computed structural propertiesFilling in

XLogP
2.9
Topological polar surface area
96 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
24
Formal charge
0
Complexity
456

Related reactions

2 records
New reaction record
HRID 1223021 reaction equation
HRID 1223021As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1517670 reaction equation
HRID 1517670As productuspto-grants-2012_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes