V029-1342 Screening compound: 2-(benzyloxy)-N-[2-(pyrrolidine-1-carbonyl)-1H-indol-5-yl]acetamide

V029-1342 Screening compound: 2-(benzyloxy)-N-[2-(pyrrolidine-1-carbonyl)-1H-indol-5-yl]acetamide
V029-1342 Screening compound: 2-(benzyloxy)-N-[2-(pyrrolidine-1-carbonyl)-1H-indol-5-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-1342
2-(benzyloxy)-N-[2-(pyrrolidine-1-carbonyl)-1H-indol-5-yl]acetamide

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

V029-1342

Molecular Formula

C22H23N3O3 (C22 H23 N3 O3)

Compound Name

2-(benzyloxy)-N-[2-(pyrrolidine-1-carbonyl)-1H-indol-5-yl]acetamide

IUPAC name

2-(benzyloxy)-N-[2-(pyrrolidine-1-carbonyl)-1H-indol-5-yl]acetamide

SMILES

O=C(COCc1ccccc1)Nc(cc1)cc2c1[nH]c(C(N1CCCC1)=O)c2

InChI

InChI=1S/C22H23N3O3/c26-21(15-28-14-16-6-2-1-3-7-16)23-18-8-9-19-17(12-18)13-20(24-19)22(27)25-10-4-5-11-25/h1-3,6-9,12-13,24H,4-5,10-11,14-15H2,(H,23,26)

InChI Key

COVCHCIHYJENAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19780295

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

377.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.502

Distribution Coefficient, logD

3.502

Water Solubility, LogSw

-3.72

Polar Surface Area

57.914

Acid Dissociation Constant (pKa)

11.55

Base Dissociation Constant (pKb)

-0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.27

V029-1342 in Drug Discovery

Included in Screening Libraries

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

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V029-1342 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-1342?
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What is the minimum amount of V029-1342 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-1342
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-1342
  • 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 V029-1342 available by request