3-[[2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4-methylbenzoic acid
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![3-[[2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4-methylbenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ebdf0211390e435ca916d5b8ab22fc84.png "3-[[2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4-methylbenzoic acid")
3-[[2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4-methylbenzoic acid
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CAS No:
730965-92-1
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Formula:
C24H25FN4O3S
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Chemical Name:
3-[[2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4-methylbenzoic acid
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Synonyms:
MLS002252311;CHEMBL1892167;HMS3076M17;ZINC3279580;AKOS033740067;MCULE-6903558135;SMR001314658;Z20260444;3-(2-{[4-cyclohexyl-5-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)-4-methylbenzoic acid;730965-92-1
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CAS No:
3-[[2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-4-methylbenzoic acid Basic Attributes
468.5 g/mol
468.16314001 g/mol
Computed Properties
Molecular Weight:468.5
XLogP3:4.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:468.16314001
Monoisotopic Mass:468.16314001
Topological Polar Surface Area:122
Heavy Atom Count:33
Complexity:680
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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