V031-3121 Screening compound: 3-{[2-(3-bromophenyl)quinazolin-4-yl][(furan-2-yl)methyl]amino}-N-[(furan-2-yl)methyl]propanamide

V031-3121 Screening compound: 3-{[2-(3-bromophenyl)quinazolin-4-yl][(furan-2-yl)methyl]amino}-N-[(furan-2-yl)methyl]propanamide
V031-3121 Screening compound: 3-{[2-(3-bromophenyl)quinazolin-4-yl][(furan-2-yl)methyl]amino}-N-[(furan-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-3121
3-{[2-(3-bromophenyl)quinazolin-4-yl][(furan-2-yl)methyl]amino}-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

V031-3121

Molecular Formula

C27H23BrN4O3 (C27 H23 BrN4 O3)

Compound Name

3-{[2-(3-bromophenyl)quinazolin-4-yl][(furan-2-yl)methyl]amino}-N-[(furan-2-yl)methyl]propanamide

IUPAC name

3-{[2-(3-bromophenyl)quinazolin-4-yl][(furan-2-yl)methyl]amino}-N-[(furan-2-yl)methyl]propanamide

SMILES

O=C(CCN(Cc1ccco1)c1nc(-c2cccc(Br)c2)nc2ccccc12)NCc1ccco1

InChI

InChI=1S/C27H23BrN4O3/c28-20-7-3-6-19(16-20)26-30-24-11-2-1-10-23(24)27(31-26)32(18-22-9-5-15-35-22)13-12-25(33)29-17-21-8-4-14-34-21/h1-11,14-16H,12-13,17-18H2,(H,29,33)

InChI Key

HMRPPBPLAZRCQH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19778895

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

531.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.814

Distribution Coefficient, logD

6.211

Water Solubility, LogSw

-6.43

Polar Surface Area

60.877

Acid Dissociation Constant (pKa)

12.62

Base Dissociation Constant (pKb)

7.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

References: we are preparing a list of scientific research reports with V031-3121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-3121?
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What is the minimum amount of V031-3121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-3121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-3121
  • 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 V031-3121 available by request