V030-0962 Screening compound: 3-[4-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-N-[(furan-2-yl)methyl]propanamide

V030-0962 Screening compound: 3-[4-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-N-[(furan-2-yl)methyl]propanamide
V030-0962 Screening compound: 3-[4-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-N-[(furan-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-0962
3-[4-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-N-[(furan-2-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

V030-0962

Molecular Formula

C29H25ClN2O3 (C29 H25 ClN2 O3)

Compound Name

3-[4-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-N-[(furan-2-yl)methyl]propanamide

IUPAC name

3-[4-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-N-[(furan-2-yl)methyl]propanamide

SMILES

O=C(CC(c1c[nH]c(cc2)c1cc2Cl)c(cc1)ccc1OCc1ccccc1)NCc1ccco1

InChI

InChI=1S/C29H25ClN2O3/c30-22-10-13-28-26(15-22)27(18-31-28)25(16-29(33)32-17-24-7-4-14-34-24)21-8-11-23(12-9-21)35-19-20-5-2-1-3-6-20/h1-15,18,25,31H,16-17,19H2,(H,32,33)/t25-/m1/s1

InChI Key

FAABVTYDYHUDIC-RUZDIDTESA-N

MDL Number (MFCD)

MFCD19779656

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

484.98

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.540

Distribution Coefficient, logD

6.540

Water Solubility, LogSw

-6.65

Polar Surface Area

49.014

Acid Dissociation Constant (pKa)

11.82

Base Dissociation Constant (pKb)

-2.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.80

V030-0962 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

MCL1 Targeted Library (12200 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V030-0962 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-0962?
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What is the minimum amount of V030-0962 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-0962
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-0962
  • 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 V030-0962 available by request