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(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone

(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone structure

CAS No:
753474-87-2
Formula:
C22H25ClN2O5S
Chemical Name:
(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone
Synonyms:
MLS002248498;CHEMBL1721833;HMS3069H21;ZINC2660512;AKOS034111771;MCULE-4626867205;SMR001315964;Z29864003;2-[4-chloro-3-(pyrrolidine-1-sulfonyl)benzoyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline;753474-87-2

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(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Basic Attributes

Molecular Weight：

465.0 g/mol

Exact Mass：

464.1172708 g/mol

Characteristics

PSA：

84.5 Å²

Water Solubility：

>69.7 [ug/mL]

Computed Properties

Molecular Weight:465.0
XLogP3:3.1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:464.1172708
Monoisotopic Mass:464.1172708
Topological Polar Surface Area:84.5
Heavy Atom Count:31
Complexity:739
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Basic Attributes
Characteristics
Computed Properties

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