V003-6731 Screening compound: N-(3-{2-[(cyclopropylmethyl)(propyl)amino]ethyl}-1H-indol-5-yl)-2-phenylcyclopropane-1-carboxamide

V003-6731 Screening compound: N-(3-{2-[(cyclopropylmethyl)(propyl)amino]ethyl}-1H-indol-5-yl)-2-phenylcyclopropane-1-carboxamide
V003-6731 Screening compound: N-(3-{2-[(cyclopropylmethyl)(propyl)amino]ethyl}-1H-indol-5-yl)-2-phenylcyclopropane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-6731
N-(3-{2-[(cyclopropylmethyl)(propyl)amino]ethyl}-1H-indol-5-yl)-2-phenylcyclopropane-1-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

V003-6731

Molecular Formula

C27H33N3O (C27 H33 N3 O)

Compound Name

N-(3-{2-[(cyclopropylmethyl)(propyl)amino]ethyl}-1H-indol-5-yl)-2-phenylcyclopropane-1-carboxamide

IUPAC name

(2R)-N-(3-{2-[(cyclopropylmethyl)(propyl)amino]ethyl}-1H-indol-5-yl)-2-phenylcyclopropane-1-carboxamide

SMILES

CCCN(CCc1c[nH]c(cc2)c1cc2NC(C(C1)[C@@H]1c1ccccc1)=O)CC1CC1

InChI

InChI=1S/C27H33N3O/c1-2-13-30(18-19-8-9-19)14-12-21-17-28-26-11-10-22(15-24(21)26)29-27(31)25-16-23(25)20-6-4-3-5-7-20/h3-7,10-11,15,17,19,23,25,28H,2,8-9,12-14,16,18H2,1H3,(H,29,31)/t23-,25?/m1/s1

InChI Key

PSIQMKKEKSZNEM-XQZUBTRRSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

415.58

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.467

Distribution Coefficient, logD

2.077

Water Solubility, LogSw

-5.56

Polar Surface Area

37.644

Acid Dissociation Constant (pKa)

10.48

Base Dissociation Constant (pKb)

10.79

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

44.40

V003-6731 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Indole Derivatives (10091 compounds)

PLpro Library (6343 compounds)

Antibacterial Compounds Library (13827 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Structure:
  • Cyclic compounds
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V003-6731 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-6731?
Check Price and Availability of V003-6731, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V003-6731 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-6731
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-6731
  • 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 V003-6731 available by request