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[2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate

[2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate structure

CAS No:
502973-84-4
Formula:
C23H17N3O3S2
Chemical Name:
[2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate
Synonyms:
ZINC3260052;AKOS033667216;MCULE-3549076351;Z19245182;[(2-cyanoethyl)(phenyl)carbamoyl]methyl 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate;502973-84-4

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[2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate Basic Attributes

Molecular Weight：

447.5 g/mol

Exact Mass：

447.07113376 g/mol

Characteristics

PSA：

140 Å²

Computed Properties

Molecular Weight:447.5
XLogP3:4.7
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:447.07113376
Monoisotopic Mass:447.07113376
Topological Polar Surface Area:140
Heavy Atom Count:31
Complexity:691
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] 5-(1,3-benzothiazol-2-yl)thiophene-2-carboxylate

Basic Attributes
Characteristics
Computed Properties
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