2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3-methyl-5H-pyrimido[5,4-b]indol-4-one
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![2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3-methyl-5H-pyrimido[5,4-b]indol-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8fab9a1b409b49c195df45444aac5d7d.png "2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3-methyl-5H-pyrimido[5,4-b]indol-4-one")
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3-methyl-5H-pyrimido[5,4-b]indol-4-one
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CAS No:
537668-56-7
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Formula:
C18H13ClFN3OS
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Chemical Name:
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3-methyl-5H-pyrimido[5,4-b]indol-4-one
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Synonyms:
537668-56-7;2-((2-chloro-6-fluorobenzyl)thio)-3-methyl-3H-pyrimido[5,4-b]indol-4(5H)-one;2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-3-methyl-3H,4H,5H-pyrimido[5,4-b]indol-4-one;Oprea1_202176;ZINC2720611;AKOS024585242;MCULE-5349067324;2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3-methyl-5H-pyrimido[5,4-b]indol-4-one;F0580-0091
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CAS No:
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3-methyl-5H-pyrimido[5,4-b]indol-4-one Basic Attributes
373.8 g/mol
373.0451891 g/mol
Computed Properties
Molecular Weight:373.8
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:373.0451891
Monoisotopic Mass:373.0451891
Topological Polar Surface Area:73.8
Heavy Atom Count:25
Complexity:562
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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