1697-1437 Screening compound: 4-{2-[(4E)-3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]hydrazin-1-yl}benzene-1-sulfonamide

1697-1437 Screening compound: 4-{2-[(4E)-3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]hydrazin-1-yl}benzene-1-sulfonamide
1697-1437 Screening compound: 4-{2-[(4E)-3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]hydrazin-1-yl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1697-1437
4-{2-[(4E)-3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]hydrazin-1-yl}benzene-1-sulfonamide

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

1697-1437

Molecular Formula

C19H15N7O5S2 (C19 H15 N7 O5 S2)

Compound Name

4-{2-[(4E)-3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-4,5-dihydro-1H-pyrazol-4-ylidene]hydrazin-1-yl}benzene-1-sulfonamide

IUPAC name

4-{2-[(4E)-3-methyl-1-[4-(3-nitrophenyl)-13-thiazol-2-yl]-5-oxo-45-dihydro-1H-pyrazol-4-ylidene]hydrazin-1-yl}benzene-1-sulfonamide

SMILES

CC(/C(/C1=O)=N\Nc(cc2)ccc2S(N)(=O)=O)=NN1c1nc(-c2cc([N+]([O-])=O)ccc2)cs1

InChI

InChI=1S/C19H15N7O5S2/c1-11-17(23-22-13-5-7-15(8-6-13)33(20,30)31)18(27)25(24-11)19-21-16(10-32-19)12-3-2-4-14(9-12)26(28)29/h2-10,22H,1H3,(H2,20,30,31)

InChI Key

JTMBGKWZPKKMLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01537038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.5

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

3.335

Distribution Coefficient, logD

3.334

Water Solubility, LogSw

-3.87

Polar Surface Area

139.095

Acid Dissociation Constant (pKa)

10.01

Base Dissociation Constant (pKb)

1.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

References: we are preparing a list of scientific research reports with 1697-1437 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1697-1437
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1697-1437
  • 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 1697-1437 available by request