3-benzyl-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
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![3-benzyl-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4e2c0143ca994b8db395462443494920.png "3-benzyl-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one")
3-benzyl-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
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CAS No:
730996-50-6
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Formula:
C23H21N3O2S2
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Chemical Name:
3-benzyl-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
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Synonyms:
ZINC3286795;AKOS033633591;MCULE-2488732399;Z18621370;4-benzyl-5-{[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl}-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one;730996-50-6
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CAS No:
3-benzyl-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Basic Attributes
435.6 g/mol
435.10751927 g/mol
Computed Properties
Molecular Weight:435.6
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:435.10751927
Monoisotopic Mass:435.10751927
Topological Polar Surface Area:119
Heavy Atom Count:30
Complexity:694
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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