V024-0880 Screening compound: 5-({[2-cyclopropanecarbonyl-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(pyridin-4-yl)methyl]furan-2-carboxamide

V024-0880 Screening compound: 5-({[2-cyclopropanecarbonyl-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(pyridin-4-yl)methyl]furan-2-carboxamide
V024-0880 Screening compound: 5-({[2-cyclopropanecarbonyl-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(pyridin-4-yl)methyl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-0880
5-({[2-cyclopropanecarbonyl-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(pyridin-4-yl)methyl]furan-2-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

V024-0880

Molecular Formula

C31H28FN3O4 (C31 H28 FN3 O4)

Compound Name

5-({[2-cyclopropanecarbonyl-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(pyridin-4-yl)methyl]furan-2-carboxamide

IUPAC name

5-({[2-cyclopropanecarbonyl-1-(3-fluorophenyl)-1234-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(pyridin-4-yl)methyl]furan-2-carboxamide

SMILES

O=C(C1CC1)N(CC1)C(c2cccc(F)c2)c2c1ccc(OCc1ccc(C(NCc3ccncc3)=O)o1)c2

InChI

InChI=1S/C31H28FN3O4/c32-24-3-1-2-23(16-24)29-27-17-25(7-6-21(27)12-15-35(29)31(37)22-4-5-22)38-19-26-8-9-28(39-26)30(36)34-18-20-10-13-33-14-11-20/h1-3,6-11,13-14,16-17,22,29H,4-5,12,15,18-19H2,(H,34,36)/t29-/m0/s1

InChI Key

NLGCAFPMATYGOV-LJAQVGFWSA-N

MDL Number (MFCD)

MFCD19917683

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

525.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.621

Distribution Coefficient, logD

4.618

Water Solubility, LogSw

-4.39

Polar Surface Area

65.295

Acid Dissociation Constant (pKa)

12.76

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.80

References: we are preparing a list of scientific research reports with V024-0880 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-0880?
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What is the minimum amount of V024-0880 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-0880
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-0880
  • 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 V024-0880 available by request