Y041-5109 Screening compound: N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-4,7-dimethoxy-1H-indole-2-carboxamide

Y041-5109 Screening compound: N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-4,7-dimethoxy-1H-indole-2-carboxamide
Y041-5109 Screening compound: N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-4,7-dimethoxy-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-5109
N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-4,7-dimethoxy-1H-indole-2-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

Y041-5109

Molecular Formula

C25H30N4O4 (C25 H30 N4 O4)

Compound Name

N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-4,7-dimethoxy-1H-indole-2-carboxamide

IUPAC name

N-[(2R)-1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-47-dimethoxy-1H-indole-2-carboxamide

SMILES

CC(C(N1CCN(Cc2ccccc2)CC1)=O)NC(c1cc(c(OC)ccc2OC)c2[nH]1)=O

InChI

InChI=1S/C25H30N4O4/c1-17(25(31)29-13-11-28(12-14-29)16-18-7-5-4-6-8-18)26-24(30)20-15-19-21(32-2)9-10-22(33-3)23(19)27-20/h4-10,15,17,27H,11-14,16H2,1-3H3,(H,26,30)/t17-/m0/s1

InChI Key

QZRKCVPLJHJRGJ-KRWDZBQOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.364

Distribution Coefficient, logD

2.339

Water Solubility, LogSw

-2.92

Polar Surface Area

69.656

Acid Dissociation Constant (pKa)

13.31

Base Dissociation Constant (pKb)

6.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.00

Y041-5109 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y041-5109 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-5109?
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What is the minimum amount of Y041-5109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-5109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-5109
  • 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 Y041-5109 available by request