 Home > Encyclopedia > 12-oxo-9-thia-2,14,21-triazapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),3,5,7,10,13,15,17,19-nonaene-11-carbonitrile

12-oxo-9-thia-2,14,21-triazapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),3,5,7,10,13,15,17,19-nonaene-11-carbonitrile

12-oxo-9-thia-2,14,21-triazapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),3,5,7,10,13,15,17,19-nonaene-11-carbonitrile structure

CAS No:
327080-27-3
Formula:
C18H8N4OS
Chemical Name:
12-oxo-9-thia-2,14,21-triazapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),3,5,7,10,13,15,17,19-nonaene-11-carbonitrile
Synonyms:
Oprea1_349964;ZINC3192106;AKOS034455016;MCULE-9381792354;SR-01000028997;SR-01000028997-1;Z56789532;12-oxo-9-thia-2,14,21-triazapentacyclo[11.8.0.0^{2,10}.0^{3,8}.0^{15,20}]henicosa-1(13),3(8),4,6,10,14,16,18,20-nonaene-11-carbonitrile;327080-27-3

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12-oxo-9-thia-2,14,21-triazapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),3,5,7,10,13,15,17,19-nonaene-11-carbonitrile Basic Attributes

Molecular Weight：

328.3 g/mol

Exact Mass：

328.04188206 g/mol

Characteristics

PSA：

95.2 Å²

Computed Properties

Molecular Weight:328.3
XLogP3:3.5
Hydrogen Bond Acceptor Count:6
Exact Mass:328.04188206
Monoisotopic Mass:328.04188206
Topological Polar Surface Area:95.2
Heavy Atom Count:24
Complexity:653
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 12-oxo-9-thia-2,14,21-triazapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(21),3,5,7,10,13,15,17,19-nonaene-11-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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