4740-0423 Screening compound: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N'-[(Z)-{2-[(4-nitrophenyl)methoxy]phenyl}methylidene]acetohydrazide

4740-0423 Screening compound: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N'-[(Z)-{2-[(4-nitrophenyl)methoxy]phenyl}methylidene]acetohydrazide
4740-0423 Screening compound: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N'-[(Z)-{2-[(4-nitrophenyl)methoxy]phenyl}methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4740-0423
2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N'-[(Z)-{2-[(4-nitrophenyl)methoxy]phenyl}methylidene]acetohydrazide

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

4740-0423

Molecular Formula

C22H21N5O4S (C22 H21 N5 O4 S)

Compound Name

2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N'-[(Z)-{2-[(4-nitrophenyl)methoxy]phenyl}methylidene]acetohydrazide

IUPAC name

2-[(46-dimethylpyrimidin-2-yl)sulfanyl]-N'-[(Z)-{2-[(4-nitrophenyl)methoxy]phenyl}methylidene]acetohydrazide

SMILES

Cc1nc(SCC(N/N=C\c(cccc2)c2OCc(cc2)ccc2[N+]([O-])=O)=O)nc(C)c1

InChI

InChI=1S/C22H21N5O4S/c1-15-11-16(2)25-22(24-15)32-14-21(28)26-23-12-18-5-3-4-6-20(18)31-13-17-7-9-19(10-8-17)27(29)30/h3-12H,13-14H2,1-2H3,(H,26,28)

InChI Key

RIGKADFEPGMGDY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04085982

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.353

Distribution Coefficient, logD

4.353

Water Solubility, LogSw

-4.53

Polar Surface Area

92.943

Acid Dissociation Constant (pKa)

11.33

Base Dissociation Constant (pKb)

2.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with 4740-0423 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4740-0423?
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What is the minimum amount of 4740-0423 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4740-0423
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4740-0423
  • 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 4740-0423 available by request