S812-0452 Screening compound: 1-[9-CYCLOPENTYL-6,7-DIHYDRO-5H-IMIDAZO[1,2-A][1,4]DIAZEPIN-8(9H)-YL]-2-MORPHOLINO-1-ETHANONE

S812-0452 Screening compound: 1-[9-CYCLOPENTYL-6,7-DIHYDRO-5H-IMIDAZO[1,2-A][1,4]DIAZEPIN-8(9H)-YL]-2-MORPHOLINO-1-ETHANONE
S812-0452 Screening compound: 1-[9-CYCLOPENTYL-6,7-DIHYDRO-5H-IMIDAZO[1,2-A][1,4]DIAZEPIN-8(9H)-YL]-2-MORPHOLINO-1-ETHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound S812-0452
1-[9-CYCLOPENTYL-6,7-DIHYDRO-5H-IMIDAZO[1,2-A][1,4]DIAZEPIN-8(9H)-YL]-2-MORPHOLINO-1-ETHANONE

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

S812-0452

Molecular Formula

C18H28N4O2 (C18 H28 N4 O2)

Compound Name

1-[9-CYCLOPENTYL-6,7-DIHYDRO-5H-IMIDAZO[1,2-A][1,4]DIAZEPIN-8(9H)-YL]-2-MORPHOLINO-1-ETHANONE

IUPAC name

n/a

SMILES

O=C(CN1CCOCC1)N1C(C2CCCC2)c2nccn2CCC1

InChI

InChI=1S/C18H28N4O2/c23-16(14-20-10-12-24-13-11-20)22-8-3-7-21-9-6-19-18(21)17(22)15-4-1-2-5-15/h6,9,15,17H,1-5,7-8,10-14H2/t17-/m0/s1

InChI Key

WFYNESHRPBSUDW-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD30465422

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.623

Distribution Coefficient, logD

0.517

Water Solubility, LogSw

-0.71

Polar Surface Area

40.646

Acid Dissociation Constant (pKa)

24.76

Base Dissociation Constant (pKb)

6.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

77.80

References: we are preparing a list of scientific research reports with S812-0452 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S812-0452?
Check Price and Availability of S812-0452, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of S812-0452 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S812-0452
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S812-0452
  • 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 S812-0452 available by request