2-(2-n-propoxy-5-morpholinosulfonylphenyl)-8-bromoquinazolin-4(3H)-one

HCID 136186409
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Basic information

Standard SMILES
CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1-c1nc2c(Br)cccc2c(=O)[nH]1
InChIKey
JDFRPHNSYOQGAS-UHFFFAOYSA-N
Molecular formula
C21H22BrN3O5S
Average molar mass
508.4 g/mol
Monoisotopic mass
507.04635

Names & identifiers

Preferred name
2-(2-n-propoxy-5-morpholinosulfonylphenyl)-8-bromoquinazolin-4(3H)-one
IUPAC
8-bromo-2-(5-morpholin-4-ylsulfonyl-2-propoxyphenyl)-3H-quinazolin-4-one

Names & synonyms

SCHEMBL7904959JDFRPHNSYOQGAS-UHFFFAOYSA-N2-(2-n-propoxy-5-morpholinosulfonylphenyl)-8-bromoquinazolin-4(3H)-one

Database identifiers

PubChem CID
136186409

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
106 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
31

Related reactions

4 records
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Compound notes

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