V031-1754 Screening compound: 5-cyclopropaneamido-1-[(2,5-dimethylphenyl)methyl]-N-[2-(pyridin-2-yl)ethyl]-1H-indole-2-carboxamide

V031-1754 Screening compound: 5-cyclopropaneamido-1-[(2,5-dimethylphenyl)methyl]-N-[2-(pyridin-2-yl)ethyl]-1H-indole-2-carboxamide
V031-1754 Screening compound: 5-cyclopropaneamido-1-[(2,5-dimethylphenyl)methyl]-N-[2-(pyridin-2-yl)ethyl]-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-1754
5-cyclopropaneamido-1-[(2,5-dimethylphenyl)methyl]-N-[2-(pyridin-2-yl)ethyl]-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

V031-1754

Molecular Formula

C29H30N4O2 (C29 H30 N4 O2)

Compound Name

5-cyclopropaneamido-1-[(2,5-dimethylphenyl)methyl]-N-[2-(pyridin-2-yl)ethyl]-1H-indole-2-carboxamide

IUPAC name

5-cyclopropaneamido-1-[(25-dimethylphenyl)methyl]-N-[2-(pyridin-2-yl)ethyl]-1H-indole-2-carboxamide

SMILES

Cc1cc(Cn(c(C(NCCc2ncccc2)=O)c2)c(cc3)c2cc3NC(C2CC2)=O)c(C)cc1

InChI

InChI=1S/C29H30N4O2/c1-19-6-7-20(2)23(15-19)18-33-26-11-10-25(32-28(34)21-8-9-21)16-22(26)17-27(33)29(35)31-14-12-24-5-3-4-13-30-24/h3-7,10-11,13,15-17,21H,8-9,12,14,18H2,1-2H3,(H,31,35)(H,32,34)

InChI Key

FPZODBMDESEZKE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19779655

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

466.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.305

Distribution Coefficient, logD

5.305

Water Solubility, LogSw

-5.13

Polar Surface Area

58.105

Acid Dissociation Constant (pKa)

13.33

Base Dissociation Constant (pKb)

4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.60

V031-1754 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V031-1754 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-1754?
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What is the minimum amount of V031-1754 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-1754
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-1754
  • 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 V031-1754 available by request