Y502-2970 Screening compound: N-{1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-1,5-dihydro-4H-pyrazol-4-yliden]ethyl}-3,4,5-triethoxybenzohydrazide

Y502-2970 Screening compound: N-{1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-1,5-dihydro-4H-pyrazol-4-yliden]ethyl}-3,4,5-triethoxybenzohydrazide
Y502-2970 Screening compound: N-{1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-1,5-dihydro-4H-pyrazol-4-yliden]ethyl}-3,4,5-triethoxybenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y502-2970
N-{1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-1,5-dihydro-4H-pyrazol-4-yliden]ethyl}-3,4,5-triethoxybenzohydrazide

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

Y502-2970

Molecular Formula

C28H33N5O5S (C28 H33 N5 O5 S)

Compound Name

N-{1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-1,5-dihydro-4H-pyrazol-4-yliden]ethyl}-3,4,5-triethoxybenzohydrazide

IUPAC name

N'-{1-[(4Z)-1-(13-benzothiazol-2-yl)-5-oxo-3-propyl-45-dihydro-1H-pyrazol-4-ylidene]ethyl}-345-triethoxybenzohydrazide

SMILES

CCCC(/C(/C1=O)=C(\C)/NNC(c(cc2OCC)cc(OCC)c2OCC)=O)=NN1c1nc(cccc2)c2s1

InChI

InChI=1S/C28H33N5O5S/c1-6-12-20-24(27(35)33(32-20)28-29-19-13-10-11-14-23(19)39-28)17(5)30-31-26(34)18-15-21(36-7-2)25(38-9-4)22(16-18)37-8-3/h10-11,13-16,30H,6-9,12H2,1-5H3,(H,31,34)

InChI Key

RCHXBSVHIDSVPW-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

551.67

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.106

Distribution Coefficient, logD

4.137

Water Solubility, LogSw

-4.92

Polar Surface Area

95.896

Acid Dissociation Constant (pKa)

8.95

Base Dissociation Constant (pKb)

8.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.71

References: we are preparing a list of scientific research reports with Y502-2970 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y502-2970?
Check Price and Availability of Y502-2970, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y502-2970 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y502-2970
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y502-2970
  • 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 Y502-2970 available by request