V028-5851 Screening compound: 5-{[(3-bromophenyl)carbamoyl]amino}-N-cyclopropyl-2-(pyrrolidin-1-yl)benzamide

V028-5851 Screening compound: 5-{[(3-bromophenyl)carbamoyl]amino}-N-cyclopropyl-2-(pyrrolidin-1-yl)benzamide
V028-5851 Screening compound: 5-{[(3-bromophenyl)carbamoyl]amino}-N-cyclopropyl-2-(pyrrolidin-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-5851
5-{[(3-bromophenyl)carbamoyl]amino}-N-cyclopropyl-2-(pyrrolidin-1-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

V028-5851

Molecular Formula

C21H23BrN4O2 (C21 H23 BrN4 O2)

Compound Name

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

IUPAC name

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

SMILES

O=C(c(cc(cc1)NC(Nc2cccc(Br)c2)=O)c1N1CCCC1)NC1CC1

InChI

InChI=1S/C21H23BrN4O2/c22-14-4-3-5-16(12-14)24-21(28)25-17-8-9-19(26-10-1-2-11-26)18(13-17)20(27)23-15-6-7-15/h3-5,8-9,12-13,15H,1-2,6-7,10-11H2,(H,23,27)(H2,24,25,28)

InChI Key

UTSYRHHQPJCMSF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19721551

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

443.34

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

5.119

Distribution Coefficient, logD

5.119

Water Solubility, LogSw

-5.24

Polar Surface Area

60.529

Acid Dissociation Constant (pKa)

11.62

Base Dissociation Constant (pKb)

2.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

V028-5851 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V028-5851 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-5851?
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What is the minimum amount of V028-5851 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-5851
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-5851
  • 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 V028-5851 available by request