 Home > Encyclopedia > 2-[[5-[(9-chloroindolo[3,2-b]quinoxalin-6-yl)methyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid

2-[[5-[(9-chloroindolo[3,2-b]quinoxalin-6-yl)methyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid

2-[[5-[(9-chloroindolo[3,2-b]quinoxalin-6-yl)methyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid structure

CAS No:
116989-81-2
Formula:
C26H19ClN6O3S
Chemical Name:
2-[[5-[(9-chloroindolo[3,2-b]quinoxalin-6-yl)methyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid

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2-[[5-[(9-chloroindolo[3,2-b]quinoxalin-6-yl)methyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Basic Attributes

Molecular Weight：

530.98500

Exact Mass：

530.0927874

DSSTox ID：

DTXSID00151647

Characteristics

PSA：

133.25000

XLogP3：

5.20540

Density：

1.54g/cm3

Boiling Point：

780ºC at 760mmHg

Flash Point：

425.5ºC

Refractive Index：

1.767

Vapor Pressure：

1.3E-25mmHg at 25°C

Computed Properties

Molecular Weight:531.0
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:530.0927874
Monoisotopic Mass:530.0927874
Topological Polar Surface Area:133
Heavy Atom Count:37
Complexity:806
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[5-[(9-chloroindolo[3,2-b]quinoxalin-6-yl)methyl]-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid

Basic Attributes
Characteristics
Computed Properties
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