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Structure

2-[1-(Azepan-1-yl)-3-(2-oxopyrrolidin-1-yl)propan-2-yl]sulfanyl-3-phenylquinazolin-4-one hydrochloride

CAS
117039-05-1
Catalog Number
ACM117039051
Category
Other Products
Molecular Weight
513.095 g/mol
Molecular Formula
C27H33ClN4O2S

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Specification

Synonyms
4(3H)-Quinazolinone, 2-((1-((hexahydro-1H-azepin-1-yl)methyl)-2-(2-oxo-1-pyrrolidinyl)ethyl)thio)-3-phenyl-, monohydrochloride, AC1Q3ELY, AC1L2076, LS-140940, 117039-05-1, 2-[1-(azepan-1-yl)-3-(2-oxopyrrolidin-1-yl)propan-2-yl]sulfanyl-3-phenylquinazolin-4-one hydrochloride
IUPAC Name
2-[1-(azepan-1-yl)-3-(2-oxopyrrolidin-1-yl)propan-2-yl]sulfanyl-3-phenylquinazolin-4-one;hydrochloride
Canonical SMILES
C1CCCN(CC1)CC(CN2CCCC2=O)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5.Cl
InChI Key
VXMADGMIEPZPJJ-UHFFFAOYSA-N
Boiling Point
685.6ºC at 760mmHg
Flash Point
368.4ºC
Exact Mass
512.20100
H-Bond Acceptor
5
H-Bond Donor
1
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