S840-0019 Screening compound: 2-methyl-1-{4-[8-(2-methylpropyl)-5H,6H,7H,8H,9H-imidazo[1,2-a][1,4]diazepin-9-yl]piperidin-1-yl}propan-1-one

S840-0019 Screening compound: 2-methyl-1-{4-[8-(2-methylpropyl)-5H,6H,7H,8H,9H-imidazo[1,2-a][1,4]diazepin-9-yl]piperidin-1-yl}propan-1-one
S840-0019 Screening compound: 2-methyl-1-{4-[8-(2-methylpropyl)-5H,6H,7H,8H,9H-imidazo[1,2-a][1,4]diazepin-9-yl]piperidin-1-yl}propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S840-0019
2-methyl-1-{4-[8-(2-methylpropyl)-5H,6H,7H,8H,9H-imidazo[1,2-a][1,4]diazepin-9-yl]piperidin-1-yl}propan-1-one

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

S840-0019

Molecular Formula

C20H34N4O (C20 H34 N4 O)

Compound Name

2-methyl-1-{4-[8-(2-methylpropyl)-5H,6H,7H,8H,9H-imidazo[1,2-a][1,4]diazepin-9-yl]piperidin-1-yl}propan-1-one

IUPAC name

2-methyl-1-{4-[8-(2-methylpropyl)-5H6H7H8H9H-imidazo[12-a][14]diazepin-9-yl]piperidin-1-yl}propan-1-one

SMILES

CC(C)CN1C(C(CC2)CCN2C(C(C)C)=O)c2nccn2CCC1

InChI

InChI=1S/C20H34N4O/c1-15(2)14-24-10-5-9-22-13-8-21-19(22)18(24)17-6-11-23(12-7-17)20(25)16(3)4/h8,13,15-18H,5-7,9-12,14H2,1-4H3/t18-/m0/s1

InChI Key

PPXBMKUUOMGYOT-SFHVURJKSA-N

MDL Number (MFCD)

MFCD30465456

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.523

Distribution Coefficient, logD

0.366

Water Solubility, LogSw

-2.20

Polar Surface Area

33.144

Acid Dissociation Constant (pKa)

22.91

Base Dissociation Constant (pKb)

9.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

80.00

References: we are preparing a list of scientific research reports with S840-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S840-0019?
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What is the minimum amount of S840-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S840-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S840-0019
  • 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 S840-0019 available by request