C700-2260 Screening compound: N-[(3-methoxyphenyl)methyl]-4-oxo-4-{4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}butanamide

C700-2260 Screening compound: N-[(3-methoxyphenyl)methyl]-4-oxo-4-{4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}butanamide
C700-2260 Screening compound: N-[(3-methoxyphenyl)methyl]-4-oxo-4-{4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C700-2260
N-[(3-methoxyphenyl)methyl]-4-oxo-4-{4H,5H-pyrrolo[1,2-a]quinoxalin-5-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

C700-2260

Molecular Formula

C23H23N3O3 (C23 H23 N3 O3)

Compound Name

N-[(3-methoxyphenyl)methyl]-4-oxo-4-{4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}butanamide

IUPAC name

N-[(3-methoxyphenyl)methyl]-4-oxo-4-{4H5H-pyrrolo[12-a]quinoxalin-5-yl}butanamide

SMILES

COc1cccc(CNC(CCC(N(C2)c(cccc3)c3-n3c2ccc3)=O)=O)c1

InChI

InChI=1S/C23H23N3O3/c1-29-19-8-4-6-17(14-19)15-24-22(27)11-12-23(28)26-16-18-7-5-13-25(18)20-9-2-3-10-21(20)26/h2-10,13-14H,11-12,15-16H2,1H3,(H,24,27)

InChI Key

ZNXNDKPUITWMNY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14785884

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.926

Distribution Coefficient, logD

2.926

Water Solubility, LogSw

-3.40

Polar Surface Area

48.941

Acid Dissociation Constant (pKa)

13.44

Base Dissociation Constant (pKb)

-0.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

C700-2260 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C700-2260 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C700-2260?
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What is the minimum amount of C700-2260 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C700-2260
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C700-2260
  • 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 C700-2260 available by request