V014-9295 Screening compound: 5-{[(3-bromophenyl)carbamoyl]amino}-N-cyclopropyl-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)benzamide

V014-9295 Screening compound: 5-{[(3-bromophenyl)carbamoyl]amino}-N-cyclopropyl-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)benzamide
V014-9295 Screening compound: 5-{[(3-bromophenyl)carbamoyl]amino}-N-cyclopropyl-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-9295
5-{[(3-bromophenyl)carbamoyl]amino}-N-cyclopropyl-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)benzamide

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

V014-9295

Molecular Formula

C26H25BrN4O2 (C26 H25 BrN4 O2)

Compound Name

5-{[(3-bromophenyl)carbamoyl]amino}-N-cyclopropyl-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)benzamide

IUPAC name

5-{[(3-bromophenyl)carbamoyl]amino}-N-cyclopropyl-2-(1234-tetrahydroisoquinolin-2-yl)benzamide

SMILES

O=C(c(cc(cc1)NC(Nc2cccc(Br)c2)=O)c1N(CC1)Cc2c1cccc2)NC1CC1

InChI

InChI=1S/C26H25BrN4O2/c27-19-6-3-7-21(14-19)29-26(33)30-22-10-11-24(23(15-22)25(32)28-20-8-9-20)31-13-12-17-4-1-2-5-18(17)16-31/h1-7,10-11,14-15,20H,8-9,12-13,16H2,(H,28,32)(H2,29,30,33)

InChI Key

GSTOPTCDVICAME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14241707

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

505.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.204

Distribution Coefficient, logD

6.204

Water Solubility, LogSw

-5.98

Polar Surface Area

59.825

Acid Dissociation Constant (pKa)

11.62

Base Dissociation Constant (pKb)

7.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

V014-9295 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with V014-9295 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-9295?
Check Price and Availability of V014-9295, 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 V014-9295 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-9295
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-9295
  • 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 V014-9295 available by request