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

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

CAS No:
669718-81-4
Formula:
C21H17ClN4O3S
Chemical Name:
ethyl 2-(1,3-benzoxazol-2-ylamino)-4-[(4-chlorophenyl)sulfanylmethyl]pyrimidine-5-carboxylate
Synonyms:
HMS1619G11;ZINC9111305;STL070949;AKOS001711238;MCULE-3020596402;669718-81-4;ethyl 2-(1,3-benzoxazol-2-ylamino)-4-{[(4-chlorophenyl)sulfanyl]methyl}pyrimidine-5-carboxylate;ethyl 2-(1,3-benzoxazol-2-ylamino)-4-{[(4-chlorophenyl)thio]methyl}pyrimidine-5-carboxylate

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

Molecular Weight：

440.9 g/mol

Exact Mass：

440.0709893 g/mol

Characteristics

PSA：

115 Å²

Computed Properties

Molecular Weight:440.9
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:440.0709893
Monoisotopic Mass:440.0709893
Topological Polar Surface Area:115
Heavy Atom Count:30
Complexity:566
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

Basic Attributes
Characteristics
Computed Properties
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