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2-methyl-4-(1,3-thiazol-5-yl)phthalazin-1-one

2-methyl-4-(1,3-thiazol-5-yl)phthalazin-1-one structure

CAS No:
137382-10-6
Formula:
C12H9N3OS
Chemical Name:
2-methyl-4-(1,3-thiazol-5-yl)phthalazin-1-one
Synonyms:
1(2h)-phthalazinone,2-methyl-4-(5-thiazolyl); KK 562; 2-Methyl-4-(5-thiazolyl)-1(2H)-phthalazinone;

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2-methyl-4-(1,3-thiazol-5-yl)phthalazin-1-one Basic Attributes

Molecular Weight：

243.28400

Exact Mass：

243.04663309 g/mol

DSSTox ID：

DTXSID10160169

Characteristics

PSA：

76.02000

XLogP3：

2.05700

Density：

1.41g/cm3

Boiling Point：

431.8ºC

Flash Point：

214.9ºC

Refractive Index：

1.734

Vapor Pressure：

1.17E-07mmHg at 25°C

Drug Information

MeSH Entry Terms：

2-methyl-4-(5-thiazolyl)-1(2H)-phthalazinone

Computed Properties

Molecular Weight:243.29
XLogP3:2.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:243.04663309
Monoisotopic Mass:243.04663309
Topological Polar Surface Area:73.8
Heavy Atom Count:17
Complexity:358
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-methyl-4-(1,3-thiazol-5-yl)phthalazin-1-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

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