G491-0372 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

G491-0372 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
G491-0372 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G491-0372
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

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

G491-0372

Molecular Formula

C20H20N2O5 (C20 H20 N2 O5)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-77-dimethyl-25-dioxo-125678-hexahydroquinoline-3-carboxamide

SMILES

CC(C)(C1)CC(NC(C(C(Nc(cc2)cc3c2OCCO3)=O)=C2)=O)=C2C1=O

InChI

InChI=1S/C20H20N2O5/c1-20(2)9-14-12(15(23)10-20)8-13(19(25)22-14)18(24)21-11-3-4-16-17(7-11)27-6-5-26-16/h3-4,7-8H,5-6,9-10H2,1-2H3,(H,21,24)(H,22,25)

InChI Key

DUQCRHNOFQRIGK-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.226

Distribution Coefficient, logD

-2.365

Water Solubility, LogSw

-2.13

Polar Surface Area

77.249

Acid Dissociation Constant (pKa)

3.81

Base Dissociation Constant (pKb)

-1.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with G491-0372 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G491-0372?
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What is the minimum amount of G491-0372 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G491-0372
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G491-0372
  • 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 G491-0372 available by request