8007-0065 Screening compound: 2,4-dibromo-6-[(E)-(2-{4-[(3-chloro-4-methylphenyl)amino]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}hydrazin-1-ylidene)methyl]phenol

8007-0065 Screening compound: 2,4-dibromo-6-[(E)-(2-{4-[(3-chloro-4-methylphenyl)amino]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}hydrazin-1-ylidene)methyl]phenol
8007-0065 Screening compound: 2,4-dibromo-6-[(E)-(2-{4-[(3-chloro-4-methylphenyl)amino]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}hydrazin-1-ylidene)methyl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-0065
2,4-dibromo-6-[(E)-(2-{4-[(3-chloro-4-methylphenyl)amino]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}hydrazin-1-ylidene)methyl]phenol

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8007-0065

Molecular Formula

C21H20Br2ClN7O2 (C21 H20 Br2 ClN7 O2)

Compound Name

2,4-dibromo-6-[(E)-(2-{4-[(3-chloro-4-methylphenyl)amino]-6-(morpholin-4-yl)-1,3,5-triazin-2-yl}hydrazin-1-ylidene)methyl]phenol

IUPAC name

24-dibromo-6-[(E)-(2-{4-[(3-chloro-4-methylphenyl)amino]-6-(morpholin-4-yl)-135-triazin-2-yl}hydrazin-1-ylidene)methyl]phenol

SMILES

Cc(ccc(Nc1nc(N/N=C/c2cc(Br)cc(Br)c2O)nc(N2CCOCC2)n1)c1)c1Cl

InChI

InChI=1S/C21H20Br2ClN7O2/c1-12-2-3-15(10-17(12)24)26-19-27-20(29-21(28-19)31-4-6-33-7-5-31)30-25-11-13-8-14(22)9-16(23)18(13)32/h2-3,8-11,32H,4-7H2,1H3,(H2,26,27,28,29,30)

InChI Key

GGNLKUAQURGZOJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00606886

Chemical and Physical Properties

Saltdata

CH3COOH

Molecular Weight

597.7

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

7.840

Distribution Coefficient, logD

7.735

Water Solubility, LogSw

-6.18

Polar Surface Area

88.190

Acid Dissociation Constant (pKa)

7.96

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

8007-0065 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8007-0065 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 8007-0065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-0065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-0065
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8007-0065 available by request