 Home > Encyclopedia > 8-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-3,4-dimethyl-3,8-diazabic yclo[4.3.0]nona-4,10-diene-2,7,9-trione

8-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-3,4-dimethyl-3,8-diazabic yclo[4.3.0]nona-4,10-diene-2,7,9-trione

8-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-3,4-dimethyl-3,8-diazabic yclo[4.3.0]nona-4,10-diene-2,7,9-trione structure

CAS No:
147297-08-3
Formula:
C20H21ClN4O3
Chemical Name:
8-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-3,4-dimethyl-3,8-diazabic yclo[4.3.0]nona-4,10-diene-2,7,9-trione
Synonyms:
8-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-3,4-dimethyl-3,8-diazabic yclo[4.3.0]nona-4,10-diene-2,7,9-trione

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8-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-3,4-dimethyl-3,8-diazabic yclo[4.3.0]nona-4,10-diene-2,7,9-trione Basic Attributes

Molecular Weight：

400.863

Exact Mass：

400.13

DSSTox ID：

DTXSID90163658

Characteristics

PSA：

64.2

XLogP3：

Density：

1.45±0.1 g/cm3(Predicted)

Boiling Point：

595.6±50.0 °C(Predicted)

Flash Point：

314ºC

Refractive Index：

1.687

Vapor Pressure：

3.76E-14mmHg at 25°C

Computed Properties

Molecular Weight:400.9
XLogP3:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:400.1302182
Monoisotopic Mass:400.1302182
Topological Polar Surface Area:64.2
Heavy Atom Count:28
Complexity:769
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 8-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-3,4-dimethyl-3,8-diazabic yclo[4.3.0]nona-4,10-diene-2,7,9-trione

Basic Attributes
Characteristics
Computed Properties

8-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-3,4-dimethyl-3,8-diazabic yclo[4.3.0]nona-4,10-diene-2,7,9-trione

SDS

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