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Home > Encyclopedia > [[4-Amino-5-(phenylmethyl)-2-pyrimidinyl]thio]acetic acid allyl ester

[[4-Amino-5-(phenylmethyl)-2-pyrimidinyl]thio]acetic acid allyl ester

[[4-Amino-5-(phenylmethyl)-2-pyrimidinyl]thio]acetic acid allyl ester structure

[[4-Amino-5-(phenylmethyl)-2-pyrimidinyl]thio]acetic acid allyl ester 

structure
  • CAS No:

    476302-23-5

  • Formula:

    C16H17N3O2S

  • Chemical Name:

    [[4-Amino-5-(phenylmethyl)-2-pyrimidinyl]thio]acetic acid allyl ester

  • Synonyms:

    Allyl [(4-amino-5-benzyl-2-pyrimidinyl)sulfanyl]acetate;SCHEMBL5726488;ZINC1553937;prop-2-enyl 2-(4-amino-5-benzylpyrimidin-2-yl)sulfanylacetate;(4-Amino-5-benzyl-pyrimidin-2-ylsulfanyl)-acetic Acid Allyl Ester

[[4-Amino-5-(phenylmethyl)-2-pyrimidinyl]thio]acetic acid allyl ester Basic Attributes

315.39008

315.10400

Characteristics

104.13000

2.40100

1.26

Computed Properties

Molecular Weight:315.4
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:315.10414797
Monoisotopic Mass:315.10414797
Topological Polar Surface Area:103
Heavy Atom Count:22
Complexity:361
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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