1-ethyl-2-[[3-(2-methoxyethyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzimidazole-5-carboxylic acid
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![1-ethyl-2-[[3-(2-methoxyethyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzimidazole-5-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/92a6042697f148e59cfcb0c709449e64.png "1-ethyl-2-[[3-(2-methoxyethyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzimidazole-5-carboxylic acid")
1-ethyl-2-[[3-(2-methoxyethyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzimidazole-5-carboxylic acid
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CAS No:
753469-72-6
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Formula:
C24H26N4O4S2
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Chemical Name:
1-ethyl-2-[[3-(2-methoxyethyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzimidazole-5-carboxylic acid
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Synonyms:
ZINC9661831;AKOS034444455;MCULE-4386293485;SR-03000003837;SR-03000003837-1;Z55181108;1-ethyl-2-({[4-(2-methoxyethyl)-3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl]sulfanyl}methyl)-1H-1,3-benzodiazole-5-carboxylic acid;753469-72-6
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CAS No:
1-ethyl-2-[[3-(2-methoxyethyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzimidazole-5-carboxylic acid Basic Attributes
498.6 g/mol
498.13954767 g/mol
Computed Properties
Molecular Weight:498.6
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:498.13954767
Monoisotopic Mass:498.13954767
Topological Polar Surface Area:151
Heavy Atom Count:34
Complexity:814
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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