2-[(2-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetic acid
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![2-[(2-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d294a12a63a24dc2a165eacabd2c5440.png "2-[(2-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetic acid")
2-[(2-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetic acid
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CAS No:
152998-72-6
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Formula:
C18H16N2O2S2
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Chemical Name:
2-[(2-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetic acid
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Synonyms:
ZINC2341214;STK546317;AKOS005474827;MCULE-4672201331;[(2-Phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin)-4-ylthio]acetic acid;[(2-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetic acid;152998-72-6
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CAS No:
2-[(2-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetic acid Basic Attributes
356.5 g/mol
356.06532010 g/mol
Computed Properties
Molecular Weight:356.5
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:356.06532010
Monoisotopic Mass:356.06532010
Topological Polar Surface Area:117
Heavy Atom Count:24
Complexity:458
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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