V030-9587 Screening compound: 3-{[5-(2,4-DIFLUOROPHENOXY)-2-METHYL-3-OXO-2,3-DIHYDROPYRIDAZIN-4-YL]AMINO}-N-PROPYLBENZAMIDE

V030-9587 Screening compound: 3-{[5-(2,4-DIFLUOROPHENOXY)-2-METHYL-3-OXO-2,3-DIHYDROPYRIDAZIN-4-YL]AMINO}-N-PROPYLBENZAMIDE
V030-9587 Screening compound: 3-{[5-(2,4-DIFLUOROPHENOXY)-2-METHYL-3-OXO-2,3-DIHYDROPYRIDAZIN-4-YL]AMINO}-N-PROPYLBENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-9587
3-{[5-(2,4-DIFLUOROPHENOXY)-2-METHYL-3-OXO-2,3-DIHYDROPYRIDAZIN-4-YL]AMINO}-N-PROPYLBENZAMIDE

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

V030-9587

Molecular Formula

C21H20F2N4O3 (C21 H20 F2 N4 O3)

Compound Name

3-{[5-(2,4-DIFLUOROPHENOXY)-2-METHYL-3-OXO-2,3-DIHYDROPYRIDAZIN-4-YL]AMINO}-N-PROPYLBENZAMIDE

IUPAC name

3-{[5-(24-difluorophenoxy)-2-methyl-3-oxo-23-dihydropyridazin-4-yl]amino}-N-propylbenzamide

SMILES

CCCNC(c1cccc(NC(C(N(C)N=C2)=O)=C2Oc(ccc(F)c2)c2F)c1)=O

InChI

InChI=1S/C21H20F2N4O3/c1-3-9-24-20(28)13-5-4-6-15(10-13)26-19-18(12-25-27(2)21(19)29)30-17-8-7-14(22)11-16(17)23/h4-8,10-12,26H,3,9H2,1-2H3,(H,24,28)

InChI Key

QNZKZPDAZCAXDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19828835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.915

Distribution Coefficient, logD

2.900

Water Solubility, LogSw

-3.51

Polar Surface Area

69.299

Acid Dissociation Constant (pKa)

9.33

Base Dissociation Constant (pKb)

0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with V030-9587 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-9587?
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What is the minimum amount of V030-9587 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-9587
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-9587
  • 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 V030-9587 available by request