V030-0376 Screening compound: 3-[3-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one

V030-0376 Screening compound: 3-[3-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one
V030-0376 Screening compound: 3-[3-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-0376
3-[3-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one

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

V030-0376

Molecular Formula

C28H27ClN2O2 (C28 H27 ClN2 O2)

Compound Name

3-[3-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one

IUPAC name

3-[3-(benzyloxy)phenyl]-3-(5-chloro-1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one

SMILES

O=C(CC(c1c[nH]c(cc2)c1cc2Cl)c1cc(OCc2ccccc2)ccc1)N1CCCC1

InChI

InChI=1S/C28H27ClN2O2/c29-22-11-12-27-25(16-22)26(18-30-27)24(17-28(32)31-13-4-5-14-31)21-9-6-10-23(15-21)33-19-20-7-2-1-3-8-20/h1-3,6-12,15-16,18,24,30H,4-5,13-14,17,19H2/t24-/m1/s1

InChI Key

VRSFGKSBGDRONF-XMMPIXPASA-N

MDL Number (MFCD)

MFCD19789482

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

458.99

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.246

Distribution Coefficient, logD

6.246

Water Solubility, LogSw

-6.34

Polar Surface Area

33.552

Acid Dissociation Constant (pKa)

17.49

Base Dissociation Constant (pKb)

-1.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

V030-0376 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Indole Derivatives (10091 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Structure:
  • Cyclic compounds
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V030-0376 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-0376?
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What is the minimum amount of V030-0376 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-0376
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-0376
  • 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 V030-0376 available by request