V013-2481 Screening compound: 3-(7-ethyl-1H-indol-3-yl)-3-(2-methoxyphenyl)-N-[(pyridin-4-yl)methyl]propanamide

V013-2481 Screening compound: 3-(7-ethyl-1H-indol-3-yl)-3-(2-methoxyphenyl)-N-[(pyridin-4-yl)methyl]propanamide
V013-2481 Screening compound: 3-(7-ethyl-1H-indol-3-yl)-3-(2-methoxyphenyl)-N-[(pyridin-4-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-2481
3-(7-ethyl-1H-indol-3-yl)-3-(2-methoxyphenyl)-N-[(pyridin-4-yl)methyl]propanamide

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

V013-2481

Molecular Formula

C26H27N3O2 (C26 H27 N3 O2)

Compound Name

3-(7-ethyl-1H-indol-3-yl)-3-(2-methoxyphenyl)-N-[(pyridin-4-yl)methyl]propanamide

IUPAC name

3-(7-ethyl-1H-indol-3-yl)-3-(2-methoxyphenyl)-N-[(pyridin-4-yl)methyl]propanamide

SMILES

CCc1cccc2c1[nH]cc2C(CC(NCc1ccncc1)=O)c(cccc1)c1OC

InChI

InChI=1S/C26H27N3O2/c1-3-19-7-6-9-21-23(17-29-26(19)21)22(20-8-4-5-10-24(20)31-2)15-25(30)28-16-18-11-13-27-14-12-18/h4-14,17,22,29H,3,15-16H2,1-2H3,(H,28,30)/t22-/m1/s1

InChI Key

DCAZGOREEALYCQ-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD19779689

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

413.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.380

Distribution Coefficient, logD

4.376

Water Solubility, LogSw

-4.29

Polar Surface Area

51.867

Acid Dissociation Constant (pKa)

12.43

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

V013-2481 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V013-2481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-2481?
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What is the minimum amount of V013-2481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-2481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-2481
  • 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 V013-2481 available by request