V003-8099 Screening compound: 3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-2,3-dihydropyridazin-4-yl]amino}-N-(3-methylbutyl)benzamide

V003-8099 Screening compound: 3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-2,3-dihydropyridazin-4-yl]amino}-N-(3-methylbutyl)benzamide
V003-8099 Screening compound: 3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-2,3-dihydropyridazin-4-yl]amino}-N-(3-methylbutyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-8099
3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-2,3-dihydropyridazin-4-yl]amino}-N-(3-methylbutyl)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

V003-8099

Molecular Formula

C29H29ClN4O4 (C29 H29 ClN4 O4)

Compound Name

3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-2,3-dihydropyridazin-4-yl]amino}-N-(3-methylbutyl)benzamide

IUPAC name

3-{[2-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-oxo-23-dihydropyridazin-4-yl]amino}-N-(3-methylbutyl)benzamide

SMILES

CC(C)CCNC(c1cccc(NC(C(N(c2cccc(Cl)c2)N=C2)=O)=C2Oc(cc2)ccc2OC)c1)=O

InChI

InChI=1S/C29H29ClN4O4/c1-19(2)14-15-31-28(35)20-6-4-8-22(16-20)33-27-26(38-25-12-10-24(37-3)11-13-25)18-32-34(29(27)36)23-9-5-7-21(30)17-23/h4-13,16-19,33H,14-15H2,1-3H3,(H,31,35)

InChI Key

NKOZYTWERIACAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19838294

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.03

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.891

Distribution Coefficient, logD

5.860

Water Solubility, LogSw

-6.13

Polar Surface Area

75.387

Acid Dissociation Constant (pKa)

11.18

Base Dissociation Constant (pKb)

6.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

References: we are preparing a list of scientific research reports with V003-8099 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-8099?
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What is the minimum amount of V003-8099 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-8099
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-8099
  • 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 V003-8099 available by request