0975-0126 Screening compound: butyl 2-[(2-hydroxy-N',2,2-triphenylacetohydrazido)carbonyl]benzoate

0975-0126 Screening compound: butyl 2-[(2-hydroxy-N',2,2-triphenylacetohydrazido)carbonyl]benzoate
0975-0126 Screening compound: butyl 2-[(2-hydroxy-N',2,2-triphenylacetohydrazido)carbonyl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0975-0126
butyl 2-[(2-hydroxy-N',2,2-triphenylacetohydrazido)carbonyl]benzoate

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

0975-0126

Molecular Formula

C32H30N2O5 (C32 H30 N2 O5)

Compound Name

butyl 2-[(2-hydroxy-N',2,2-triphenylacetohydrazido)carbonyl]benzoate

IUPAC name

butyl 2-[(2-hydroxy-N'22-triphenylacetohydrazido)carbonyl]benzoate

SMILES

CCCCOC(c(cccc1)c1C(N(c1ccccc1)NC(C(c1ccccc1)(c1ccccc1)O)=O)=O)=O

InChI

InChI=1S/C32H30N2O5/c1-2-3-23-39-30(36)28-22-14-13-21-27(28)29(35)34(26-19-11-6-12-20-26)33-31(37)32(38,24-15-7-4-8-16-24)25-17-9-5-10-18-25/h4-22,38H,2-3,23H2,1H3,(H,33,37)

InChI Key

JORRHRVPESAREO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00993858

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

522.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.814

Distribution Coefficient, logD

3.995

Water Solubility, LogSw

-4.61

Polar Surface Area

75.337

Acid Dissociation Constant (pKa)

6.65

Base Dissociation Constant (pKb)

-1.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.60

0975-0126 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0975-0126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0975-0126?
Check Price and Availability of 0975-0126, 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 0975-0126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0975-0126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0975-0126
  • 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 0975-0126 available by request