G933-0029 Screening compound: 1-methyl-3-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-1,2-dihydroquinoxalin-2-one

G933-0029 Screening compound: 1-methyl-3-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-1,2-dihydroquinoxalin-2-one
G933-0029 Screening compound: 1-methyl-3-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-1,2-dihydroquinoxalin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G933-0029
1-methyl-3-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-1,2-dihydroquinoxalin-2-one

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

G933-0029

Molecular Formula

C22H24N4O2 (C22 H24 N4 O2)

Compound Name

1-methyl-3-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-1,2-dihydroquinoxalin-2-one

IUPAC name

1-methyl-3-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]-12-dihydroquinoxalin-2-one

SMILES

CC(CN(CC1)C(C2=Nc(cccc3)c3N(C)C2=O)=O)N1c1cc(C)ccc1

InChI

InChI=1S/C22H24N4O2/c1-15-7-6-8-17(13-15)26-12-11-25(14-16(26)2)22(28)20-21(27)24(3)19-10-5-4-9-18(19)23-20/h4-10,13,16H,11-12,14H2,1-3H3/t16-/m0/s1

InChI Key

UTEKGDKTXFVQGE-INIZCTEOSA-N

MDL Number (MFCD)

MFCD15075482

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.649

Distribution Coefficient, logD

2.649

Water Solubility, LogSw

-3.03

Polar Surface Area

42.614

Acid Dissociation Constant (pKa)

26.19

Base Dissociation Constant (pKb)

6.38

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

G933-0029 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 G933-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G933-0029?
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What is the minimum amount of G933-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G933-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G933-0029
  • 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 G933-0029 available by request