N1-[(S)-(3-chloropyridin-2-yl)(2,2-difluoro-2H-1,3-benzodioxol-4-yl)methyl]-4-methanesulfonyl-N2-[4-methoxy-6-(piperazin-1-yl)-1,3,5-triazin-2-yl]benzene-1,2-diamine

Compound number
MolPort-047-154-370
CAS number
2565705-02-2
IUPAC
N1-[(S)-(3-chloropyridin-2-yl)(2,2-difluoro-2H-1,3-benzodioxol-4-yl)methyl]-4-methanesulfonyl-N2-[4-methoxy-6-(piperazin-1-yl)-1,3,5-triazin-2-yl]benzene-1,2-diamine
IUPAC traditional
N1-[(S)-(3-chloropyridin-2-yl)(2,2-difluoro-1,3-benzodioxol-4-yl)methyl]-4-methanesulfonyl-N2-[4-methoxy-6-(piperazin-1-yl)-1,3,5-triazin-2-yl]benzene-1,2-diamine
SMILES
COc1nc(Nc2cc(ccc2N[C@@H](c2cccc3OC(F)(F)Oc23)c2ncccc2Cl)S(C)(=O)=O)nc(n1)N1CCNCC1 |r|
InChI key
QJIMSJUUARCROQ-QFIPXVFZSA-N
Molecular formula
Molecular weight
661.08
Solubility
not available

Marketplace Offers

MedChemExpress Europe

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Screening compound
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10 business days
Purity
99.6%
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this week
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Chemscene

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Building blocks
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12 business days
Purity
>98%
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3 months ago
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5 mg June 7, 2022 500.00 USD
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10 mg June 7, 2022 850.00 USD
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More Information

Compound identifiers

Compound number
MolPort-047-154-370
CAS number
2565705-02-2

Names, Synonyms and 3rd Party Identifiers

Dot1L-IN-4

InChI

InChI
1/C28H27ClF2N8O5S/c1-42-27-37-25(36-26(38-27)39-13-11-32-12-14-39)35-20-15-16(45(2,40)41)8-9-19(20)34-22(23-18(29)6-4-10-33-23)17-5-3-7-21-24(17)44-28(30,31)43-21/h3-10,15,22,32,34H,11-14H2,1-2H3,(H,35,36,37,38)/t22-/m0/s1
InChI key
QJIMSJUUARCROQ-QFIPXVFZSA-N

Formula

Molecular formula
C28H27ClF2N8O5S
Molecular weight
661.08

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