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ethyl 2-(1,3-benzoxazol-2-ylamino)-4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]pyrimidine-5-carboxylate

ethyl 2-(1,3-benzoxazol-2-ylamino)-4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]pyrimidine-5-carboxylate structure

CAS No:
726199-56-0
Formula:
C22H18N8O3S
Chemical Name:
ethyl 2-(1,3-benzoxazol-2-ylamino)-4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]pyrimidine-5-carboxylate
Synonyms:
C22H18N8O3S;ZINC9109025;STK210145;STK578286;AKOS002277385;AKOS005502396;MCULE-9200287306;726199-56-0;ethyl 2-(1,3-benzoxazol-2-ylamino)-4-{[(1-phenyl-1H-1,2,3,4-tetraazol-5-yl)sulfanyl]methyl}-5-pyrimidinecarboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-4-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidine-5-carboxylate;ethyl 2-[(2Z)-1,3-benzoxazol-2(3H)-ylideneamino]-4-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidine-5-carboxylate

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ethyl 2-(1,3-benzoxazol-2-ylamino)-4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]pyrimidine-5-carboxylate Basic Attributes

Molecular Weight：

474.5 g/mol

Exact Mass：

474.12225764 g/mol

Characteristics

PSA：

159 Å²

Computed Properties

Molecular Weight:474.5
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:9
Exact Mass:474.12225764
Monoisotopic Mass:474.12225764
Topological Polar Surface Area:159
Heavy Atom Count:34
Complexity:672
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-(1,3-benzoxazol-2-ylamino)-4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]pyrimidine-5-carboxylate

Basic Attributes
Characteristics
Computed Properties
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