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(1S,9R)-11-(5H-pyrimido[5,4-b]indol-4-yl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
(1S,9R)-11-(5H-pyrimido[5,4-b]indol-4-yl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
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![(1S,9R)-11-(5H-pyrimido[5,4-b]indol-4-yl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9ef0606f58914518827302e1c433fd1f.png "(1S,9R)-11-(5H-pyrimido[5,4-b]indol-4-yl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one")
(1S,9R)-11-(5H-pyrimido[5,4-b]indol-4-yl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
structure -
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CAS No:
1212472-23-5
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Formula:
C21H19N5O
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Chemical Name:
(1S,9R)-11-(5H-pyrimido[5,4-b]indol-4-yl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
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Synonyms:
ZINC2115045;AKOS030499878;1212472-23-5
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CAS No:
(1S,9R)-11-(5H-pyrimido[5,4-b]indol-4-yl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one Basic Attributes
357.4 g/mol
357.15896025 g/mol
Computed Properties
Molecular Weight:357.4
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:357.15896025
Monoisotopic Mass:357.15896025
Topological Polar Surface Area:65.1
Heavy Atom Count:27
Complexity:690
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of (1S,9R)-11-(5H-pyrimido[5,4-b]indol-4-yl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one
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