7-(4-{[(4-bromophenyl)formamido]methanethioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Compound number:
MolPort-000-801-340
IUPAC:
7-(4-{[(4-bromophenyl)formamido]methanethioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
IUPAC traditional:
7-(4-{[(4-bromophenyl)formamido]methanethioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
SMILES:
CCn1cc(C(O)=O)c(=O)c2cc(F)c(cc12)N1CCN(CC1)C(=S)NC(=O)c1ccc(Br)cc1
InChI key:
GSFVYQNRFITLTB-UHFFFAOYSA-N
Molecular formula:
C24H22BrFN4O4S
Molecular weight: 561.43
Solubility: not available
Sample Reformatting

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Supplier Catalogue Data


Catalog: Screening compound Ships out: 10 business days Purity: >90%
Last updated: today In warehouse: 116.00 mg
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1 mg December 4, 2019 63.60 USD
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2 mg December 4, 2019 63.60 USD
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3 mg December 4, 2019 63.60 USD
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S&H to USA: 140.00 USD
S&H to World: 180.00 USD

Supplier Catalogue Data


Catalog: Screening compound Ships out: 10 business days Purity: 92 - 98%
Last updated: this month In warehouse: 300.00 mg
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3 micromol December 4, 2019 40.00 USD
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5 micromol December 4, 2019 44.00 USD
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10 micromol December 4, 2019 75.00 USD
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S&H to USA: 140.00 USD
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Supplier Catalogue Data


Catalog: Screening compound Ships out: 10 business days Purity: n/a
Last updated: > 3 months ago In warehouse: Unverified
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5 micromol December 4, 2019 26.00 USD
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10 micromol December 4, 2019 31.00 USD
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20 micromol December 4, 2019 37.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-000-801-340

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000017357266
7-(4-{[(4-bromobenzoyl)amino]carbonothioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
7-(4-((4-bromobenzoyl)carbamothioyl)piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
7-(4-{[(4-bromophenyl)formamido]methanethioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

InChI
InChI: 1S/C24H22BrFN4O4S/c1-2-28-13-17(23(33)34)21(31)16-11-18(26)20(12-19(16)28)29-7-9-30(10-8-29)24(35)27-22(32)14-3-5-15(25)6-4-14/h3-6,11-13H,2,7-10H2,1H3,(H,33,34)(H,27,32,35)
InChI key: GSFVYQNRFITLTB-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C24H22BrFN4O4S
Molecular weight: 561.43

Other

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2019 MolPort, v3.28, release date 17-11-2019 13:00 (+0200). All rights reserved.
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