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ethyl 2-(azepan-1-ylmethyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate

ethyl 2-(azepan-1-ylmethyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate structure

CAS No:
727706-57-2
Formula:
C17H23N3O3S
Chemical Name:
ethyl 2-(azepan-1-ylmethyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate
Synonyms:
ZINC3362369;AKOS034350773;MCULE-8776430012;SR-01000046417;SR-01000046417-1;Z44490237;ethyl 2-[(azepan-1-yl)methyl]-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate;727706-57-2

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ethyl 2-(azepan-1-ylmethyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Basic Attributes

Molecular Weight：

349.4 g/mol

Exact Mass：

349.14601278 g/mol

Characteristics

PSA：

99.2 Å²

Computed Properties

Molecular Weight:349.4
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:349.14601278
Monoisotopic Mass:349.14601278
Topological Polar Surface Area:99.2
Heavy Atom Count:24
Complexity:517
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-(azepan-1-ylmethyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Basic Attributes
Characteristics
Computed Properties
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