8017-5864 Screening compound: 2-bromo-N'-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-N'-methylpropanohydrazide

8017-5864 Screening compound: 2-bromo-N'-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-N'-methylpropanohydrazide
8017-5864 Screening compound: 2-bromo-N'-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-N'-methylpropanohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-5864
2-bromo-N'-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-N'-methylpropanohydrazide

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

8017-5864

Molecular Formula

C15H24BrN7O3 (C15 H24 BrN7 O3)

Compound Name

2-bromo-N'-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-N'-methylpropanohydrazide

IUPAC name

N'-[46-bis(morpholin-4-yl)-135-triazin-2-yl]-2-bromo-N'-methylpropanehydrazide

SMILES

CC(C(NN(C)c1nc(N2CCOCC2)nc(N2CCOCC2)n1)=O)Br

InChI

InChI=1S/C15H24BrN7O3/c1-11(16)12(24)20-21(2)13-17-14(22-3-7-25-8-4-22)19-15(18-13)23-5-9-26-10-6-23/h11H,3-10H2,1-2H3,(H,20,24)/t11-/m0/s1

InChI Key

RQTXASWVTNZHGH-NSHDSACASA-N

MDL Number (MFCD)

MFCD06616722

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.426

Distribution Coefficient, logD

2.425

Water Solubility, LogSw

-2.42

Polar Surface Area

77.613

Acid Dissociation Constant (pKa)

10.86

Base Dissociation Constant (pKb)

4.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

73.33

8017-5864 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8017-5864 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-5864
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-5864
  • 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 8017-5864 available by request