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ethyl 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxybenzoate

ethyl 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxybenzoate structure

CAS No:
55687-48-4
Formula:
C16H20N4O4
Chemical Name:
ethyl 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxybenzoate
Synonyms:
4-(2,4-Diamino-5-pyrimidinylmethyl)-2,6-dimethoxybenzoic acid ethyl ester;BENZOIC ACID, 4-(2,4-DIAMINO-5-PYRIMIDINYLMETHYL)-2,6-DIMETHOXY-, ETHYL ESTER;55687-48-4;BRN 0841492;SCHEMBL11854240;DTXSID60204209

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ethyl 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxybenzoate Basic Attributes

Molecular Weight：

332.35 g/mol

Exact Mass：

332.14845513 g/mol

DSSTox ID：

DTXSID60204209

Characteristics

PSA：

123 Å²

XLogP3：

1.25 (LogP)

Computed Properties

Molecular Weight:332.35
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:332.14845513
Monoisotopic Mass:332.14845513
Topological Polar Surface Area:123
Heavy Atom Count:24
Complexity:398
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxybenzoate

Basic Attributes
Characteristics
Computed Properties
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