8007-0531 Screening compound: ethyl 4-({2-[(E)-1-(2,5-dimethoxyphenyl)methylidene]hydrazino}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

8007-0531 Screening compound: ethyl 4-({2-[(E)-1-(2,5-dimethoxyphenyl)methylidene]hydrazino}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
8007-0531 Screening compound: ethyl 4-({2-[(E)-1-(2,5-dimethoxyphenyl)methylidene]hydrazino}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-0531
ethyl 4-({2-[(E)-1-(2,5-dimethoxyphenyl)methylidene]hydrazino}carbonyl)-3,5-dimethyl-1H-pyrrole-2-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

8007-0531

Molecular Formula

C19H23N3O5 (C19 H23 N3 O5)

Compound Name

ethyl 4-({2-[(E)-1-(2,5-dimethoxyphenyl)methylidene]hydrazino}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-{N'-[(E)-(25-dimethoxyphenyl)methylidene]hydrazinecarbonyl}-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1c(C)c(C(N/N=C/c(cc(cc2)OC)c2OC)=O)c(C)[nH]1)=O

InChI

InChI=1S/C19H23N3O5/c1-6-27-19(24)17-11(2)16(12(3)21-17)18(23)22-20-10-13-9-14(25-4)7-8-15(13)26-5/h7-10,21H,6H2,1-5H3,(H,22,23)

InChI Key

IUCMLMYIIODUKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00828047

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.383

Distribution Coefficient, logD

3.376

Water Solubility, LogSw

-3.73

Polar Surface Area

82.464

Acid Dissociation Constant (pKa)

9.24

Base Dissociation Constant (pKb)

3.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.58

References: we are preparing a list of scientific research reports with 8007-0531 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-0531?
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What is the minimum amount of 8007-0531 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-0531
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-0531
  • 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 8007-0531 available by request