V023-1040 Screening compound: ethyl 1-(3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-2,3-dihydropyridazin-4-yl]amino}benzoyl)piperidine-4-carboxylate

V023-1040 Screening compound: ethyl 1-(3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-2,3-dihydropyridazin-4-yl]amino}benzoyl)piperidine-4-carboxylate
V023-1040 Screening compound: ethyl 1-(3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-2,3-dihydropyridazin-4-yl]amino}benzoyl)piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-1040
ethyl 1-(3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-2,3-dihydropyridazin-4-yl]amino}benzoyl)piperidine-4-carboxylate

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

V023-1040

Molecular Formula

C32H31ClN4O6 (C32 H31 ClN4 O6)

Compound Name

ethyl 1-(3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-2,3-dihydropyridazin-4-yl]amino}benzoyl)piperidine-4-carboxylate

IUPAC name

ethyl 1-(3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-23-dihydropyridazin-4-yl]amino}benzoyl)piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(c1cccc(NC(C(N(c2cccc(Cl)c2)N=C2)=O)=C2Oc(cc2)ccc2OC)c1)=O)=O

InChI

InChI=1S/C32H31ClN4O6/c1-3-42-32(40)21-14-16-36(17-15-21)30(38)22-6-4-8-24(18-22)35-29-28(43-27-12-10-26(41-2)11-13-27)20-34-37(31(29)39)25-9-5-7-23(33)19-25/h4-13,18-21,35H,3,14-17H2,1-2H3

InChI Key

JJJKUTBWDXBSML-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19831653

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

603.07

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.108

Distribution Coefficient, logD

5.101

Water Solubility, LogSw

-5.61

Polar Surface Area

88.262

Acid Dissociation Constant (pKa)

11.90

Base Dissociation Constant (pKb)

0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with V023-1040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-1040?
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What is the minimum amount of V023-1040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-1040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-1040
  • 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 V023-1040 available by request