(3S)-4-[2-[1-(4-fluorophenyl)-3-propan-2-ylindol-2-yl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid
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![(3S)-4-[2-[1-(4-fluorophenyl)-3-propan-2-ylindol-2-yl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/29074d1b02694d68b96df4a3437e72dc.png "(3S)-4-[2-[1-(4-fluorophenyl)-3-propan-2-ylindol-2-yl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid")
(3S)-4-[2-[1-(4-fluorophenyl)-3-propan-2-ylindol-2-yl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid
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CAS No:
119901-68-7
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Formula:
C23H23FNO5P
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Chemical Name:
(3S)-4-[2-[1-(4-fluorophenyl)-3-propan-2-ylindol-2-yl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid
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Synonyms:
UNII-6YM2C377QB;6YM2C377QB;SQ-33600 free acid;SCHEMBL6903411;(3S)-4-[2-[1-(4-fluorophenyl)-3-propan-2-ylindol-2-yl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid;119901-68-7;(3S)-3-Hydroxy-4-[hydroxy[[1-(4-fluorophenyl)-3-isopropyl-1H-indol-2-yl]ethynyl]phosphinyl]butyric acid;Butanoic acid, 4-(((1-(4-fluorophenyl)-3-(1-methylethyl)-1H-indol-2-yl)ethynyl)hydroxyphosphinyl)-3-hydroxy-, (3S)-
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CAS No:
(3S)-4-[2-[1-(4-fluorophenyl)-3-propan-2-ylindol-2-yl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid Basic Attributes
443.4 g/mol
443.12978799 g/mol
6YM2C377QB
Computed Properties
Molecular Weight:443.4
XLogP3:2.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:443.12978799
Monoisotopic Mass:443.12978799
Topological Polar Surface Area:99.8
Heavy Atom Count:31
Complexity:754
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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