1311-2247 Screening compound: 3-benzyl-4-methyl-7-[(2Z)-2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazin-1-ylidene]ethoxy]-2H-chromen-2-one

1311-2247 Screening compound: 3-benzyl-4-methyl-7-[(2Z)-2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazin-1-ylidene]ethoxy]-2H-chromen-2-one
1311-2247 Screening compound: 3-benzyl-4-methyl-7-[(2Z)-2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazin-1-ylidene]ethoxy]-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1311-2247
3-benzyl-4-methyl-7-[(2Z)-2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazin-1-ylidene]ethoxy]-2H-chromen-2-one

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

1311-2247

Molecular Formula

C32H27N3O5 (C32 H27 N3 O5)

Compound Name

3-benzyl-4-methyl-7-[(2Z)-2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazin-1-ylidene]ethoxy]-2H-chromen-2-one

IUPAC name

3-benzyl-4-methyl-7-[(2Z)-2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazin-1-ylidene]ethoxy]-2H-chromen-2-one

SMILES

Cc(cc1)ccc1/C(/COc(cc1)cc(O2)c1C(C)=C(Cc1ccccc1)C2=O)=N/Nc(cc1)ccc1[N+]([O-])=O

InChI

InChI=1S/C32H27N3O5/c1-21-8-10-24(11-9-21)30(34-33-25-12-14-26(15-13-25)35(37)38)20-39-27-16-17-28-22(2)29(32(36)40-31(28)19-27)18-23-6-4-3-5-7-23/h3-17,19,33H,18,20H2,1-2H3

InChI Key

MDVMNGAHMOZYJE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00845861

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

7.510

Distribution Coefficient, logD

7.510

Water Solubility, LogSw

-5.69

Polar Surface Area

82.234

Acid Dissociation Constant (pKa)

13.38

Base Dissociation Constant (pKb)

4.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with 1311-2247 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1311-2247?
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What is the minimum amount of 1311-2247 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1311-2247
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1311-2247
  • 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 1311-2247 available by request