G268-0938 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1H-imidazol-1-yl)butanamide

G268-0938 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1H-imidazol-1-yl)butanamide
G268-0938 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1H-imidazol-1-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G268-0938
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1H-imidazol-1-yl)butanamide

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

G268-0938

Molecular Formula

C15H17N3O3 (C15 H17 N3 O3)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1H-imidazol-1-yl)butanamide

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-3-(1H-imidazol-1-yl)butanamide

SMILES

CC(CC(Nc(cc1)cc2c1OCCO2)=O)n1cncc1

InChI

InChI=1S/C15H17N3O3/c1-11(18-5-4-16-10-18)8-15(19)17-12-2-3-13-14(9-12)21-7-6-20-13/h2-5,9-11H,6-8H2,1H3,(H,17,19)/t11-/m0/s1

InChI Key

RZCLDJDVXKJNNW-NSHDSACASA-N

MDL Number (MFCD)

MFCD14992538

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

287.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.416

Distribution Coefficient, logD

0.180

Water Solubility, LogSw

-1.64

Polar Surface Area

51.853

Acid Dissociation Constant (pKa)

10.82

Base Dissociation Constant (pKb)

7.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

G268-0938 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G268-0938 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G268-0938?
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What is the minimum amount of G268-0938 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G268-0938
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G268-0938
  • 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 G268-0938 available by request