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6-Benzothiazolecarbonitrile,2-(1H-pyrrol-1-yl)-(9CI)

6-Benzothiazolecarbonitrile,2-(1H-pyrrol-1-yl)-(9CI) structure

CAS No:
383143-80-4
Formula:
C12H7N3S
Chemical Name:
6-Benzothiazolecarbonitrile,2-(1H-pyrrol-1-yl)-(9CI)
Synonyms:
ZINC1520029;2-(1H-Pyrrol-1-yl)-1,3-benzothiazole-6-carbonitrile

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6-Benzothiazolecarbonitrile,2-(1H-pyrrol-1-yl)-(9CI) Basic Attributes

Molecular Weight：

225.26908

Exact Mass：

225.036

Characteristics

PSA：

69.8

XLogP3：

2.8

Computed Properties

Molecular Weight:225.27
XLogP3:2.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:225.03606841
Monoisotopic Mass:225.03606841
Topological Polar Surface Area:69.8
Heavy Atom Count:16
Complexity:305
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-Benzothiazolecarbonitrile,2-(1H-pyrrol-1-yl)-(9CI)

Basic Attributes
Characteristics
Computed Properties

6-Benzothiazolecarbonitrile,2-(1H-pyrrol-1-yl)-(9CI)

SDS

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