SD56-0339 Screening compound: 8-[2-(3-methoxyphenyl)acetyl]-2-phenylhexahydro-1H-imidazo[1,5-a][1,4]diazepine-1,3(2H)-dione

SD56-0339 Screening compound: 8-[2-(3-methoxyphenyl)acetyl]-2-phenylhexahydro-1H-imidazo[1,5-a][1,4]diazepine-1,3(2H)-dione
SD56-0339 Screening compound: 8-[2-(3-methoxyphenyl)acetyl]-2-phenylhexahydro-1H-imidazo[1,5-a][1,4]diazepine-1,3(2H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound SD56-0339
8-[2-(3-methoxyphenyl)acetyl]-2-phenylhexahydro-1H-imidazo[1,5-a][1,4]diazepine-1,3(2H)-dione

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

SD56-0339

Molecular Formula

C22H23N3O4 (C22 H23 N3 O4)

Compound Name

8-[2-(3-methoxyphenyl)acetyl]-2-phenylhexahydro-1H-imidazo[1,5-a][1,4]diazepine-1,3(2H)-dione

IUPAC name

8-[2-(3-methoxyphenyl)acetyl]-2-phenyl-octahydro-1H-imidazo[15-a][14]diazepine-13-dione

SMILES

COc1cccc(CC(N(CCC2)CC(C(N3c4ccccc4)=O)N2C3=O)=O)c1

InChI

InChI=1S/C22H23N3O4/c1-29-18-10-5-7-16(13-18)14-20(26)23-11-6-12-24-19(15-23)21(27)25(22(24)28)17-8-3-2-4-9-17/h2-5,7-10,13,19H,6,11-12,14-15H2,1H3/t19-/m1/s1

InChI Key

OHLHKULCMQNILS-LJQANCHMSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.973

Distribution Coefficient, logD

1.973

Water Solubility, LogSw

-2.26

Polar Surface Area

56.083

Acid Dissociation Constant (pKa)

13.19

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.82

References: we are preparing a list of scientific research reports with SD56-0339 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD56-0339?
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What is the minimum amount of SD56-0339 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD56-0339
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD56-0339
  • 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 SD56-0339 available by request