1077-0072A Screening compound: 4-heptyl-N'-(4-nitrobenzoyl)benzohydrazide

1077-0072A Screening compound: 4-heptyl-N'-(4-nitrobenzoyl)benzohydrazide
1077-0072A Screening compound: 4-heptyl-N'-(4-nitrobenzoyl)benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1077-0072A
4-heptyl-N'-(4-nitrobenzoyl)benzohydrazide

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

1077-0072A

Molecular Formula

C21H25N3O4 (C21 H25 N3 O4)

Compound Name

4-heptyl-N'-(4-nitrobenzoyl)benzohydrazide

IUPAC name

4-heptyl-N'-(4-nitrobenzoyl)benzohydrazide

SMILES

CCCCCCCc(cc1)ccc1C(NNC(c(cc1)ccc1[N+]([O-])=O)=O)=O

InChI

InChI=1S/C21H25N3O4/c1-2-3-4-5-6-7-16-8-10-17(11-9-16)20(25)22-23-21(26)18-12-14-19(15-13-18)24(27)28/h8-15H,2-7H2,1H3,(H,22,25)(H,23,26)

InChI Key

LNPRXVASKRDUGC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00642526

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.653

Distribution Coefficient, logD

5.648

Water Solubility, LogSw

-5.26

Polar Surface Area

84.816

Acid Dissociation Constant (pKa)

9.32

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

1077-0072A in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 1077-0072A chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1077-0072A?
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What is the minimum amount of 1077-0072A you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1077-0072A
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1077-0072A
  • 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 1077-0072A available by request