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1-propan-2-yl-3-[[1,4,6,7-tetrakis(sulfanyl)pyrano[3,4-d]imidazol-4-yl]methyl]thiourea

1-propan-2-yl-3-[[1,4,6,7-tetrakis(sulfanyl)pyrano[3,4-d]imidazol-4-yl]methyl]thiourea structure

CAS No:
100650-67-7
Formula:
C11H16N4OS5
Chemical Name:
1-propan-2-yl-3-[[1,4,6,7-tetrakis(sulfanyl)pyrano[3,4-d]imidazol-4-yl]methyl]thiourea
Synonyms:
4-(N-Isopropylthiocarbamoylaminomethyl)-1(3),4,6,7-tetrahydro-1(3)H-thiopyrano(3,4-d)imidazole; Thiourea,N-(1-methylethyl)-N'-((1,4,6,7-tetrahydropyrano(3,4-d)imidazol-4-yl)methyl);

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1-propan-2-yl-3-[[1,4,6,7-tetrakis(sulfanyl)pyrano[3,4-d]imidazol-4-yl]methyl]thiourea Basic Attributes

Molecular Weight：

380.59600

Exact Mass：

379.99276701

Characteristics

PSA：

238.40000

XLogP3：

2.82880

Density：

1.64g/cm3

Boiling Point：

563.1ºC

Flash Point：

294.3ºC

Refractive Index：

1.806

Vapor Pressure：

1.06E-12mmHg at 25°C

Computed Properties

Molecular Weight:380.6
XLogP3:1.7
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:379.99276701
Monoisotopic Mass:379.99276701
Topological Polar Surface Area:87.2
Heavy Atom Count:21
Complexity:460
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-propan-2-yl-3-[[1,4,6,7-tetrakis(sulfanyl)pyrano[3,4-d]imidazol-4-yl]methyl]thiourea

Basic Attributes
Characteristics
Computed Properties

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