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Home > Encyclopedia > methyl 4-[[5-[[(2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate

methyl 4-[[5-[[(2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate

methyl 4-[[5-[[(2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate structure

methyl 4-[[5-[[(2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate 

structure
  • CAS No:

    956368-20-0

  • Formula:

    C24H26N4O4S2

  • Chemical Name:

    methyl 4-[[5-[[(2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate

  • Synonyms:

    ZINC3359039;AKOS034827520;MCULE-3496234855;Z57024541;956368-20-0;methyl 4-[({5-[(2S)-3-methyl-2-[(3-methylphenyl)formamido]butanamido]-1,3,4-thiadiazol-2-yl}sulfanyl)methyl]benzoate

methyl 4-[[5-[[(2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate Basic Attributes

498.6 g/mol

498.13954767 g/mol

Characteristics

164 Ų

Computed Properties

Molecular Weight:498.6
XLogP3:4.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:498.13954767
Monoisotopic Mass:498.13954767
Topological Polar Surface Area:164
Heavy Atom Count:34
Complexity:703
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl 4-[[5-[[(2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate

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