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3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N,N-diethyl-2-sulfanylidene-1,3-benzoxazole-5-sulfonamide

3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N,N-diethyl-2-sulfanylidene-1,3-benzoxazole-5-sulfonamide structure

CAS No:
721421-17-6
Formula:
C21H25N3O3S2
Chemical Name:
3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N,N-diethyl-2-sulfanylidene-1,3-benzoxazole-5-sulfonamide
Synonyms:
ZINC3243616;AKOS001073814;MCULE-2329700703;Z44089804;721421-17-6;N,N-diethyl-2-sulfanylidene-3-[(1,2,3,4-tetrahydroisoquinolin-2-yl)methyl]-2,3-dihydro-1,3-benzoxazole-5-sulfonamide

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3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N,N-diethyl-2-sulfanylidene-1,3-benzoxazole-5-sulfonamide Basic Attributes

Molecular Weight：

431.6 g/mol

Exact Mass：

431.13373402 g/mol

Characteristics

PSA：

93.6 Å²

Computed Properties

Molecular Weight:431.6
XLogP3:3.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:431.13373402
Monoisotopic Mass:431.13373402
Topological Polar Surface Area:93.6
Heavy Atom Count:29
Complexity:692
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N,N-diethyl-2-sulfanylidene-1,3-benzoxazole-5-sulfonamide

Basic Attributes
Characteristics
Computed Properties

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