3414-0074 Screening compound: N'~4~-(1-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undec-9-yliden)isonicotinohydrazide

3414-0074 Screening compound: N'~4~-(1-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undec-9-yliden)isonicotinohydrazide
3414-0074 Screening compound: N'~4~-(1-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undec-9-yliden)isonicotinohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3414-0074
N'~4~-(1-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undec-9-yliden)isonicotinohydrazide

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

3414-0074

Molecular Formula

C16H21N5O (C16 H21 N5 O)

Compound Name

N'~4~-(1-methyl-3,6-diazatricyclo[4.3.1.1~3,8~]undec-9-yliden)isonicotinohydrazide

IUPAC name

N'-[(9Z)-1-methyl-36-diazatricyclo[4.3.1.1^{38}]undecan-9-ylidene]pyridine-4-carbohydrazide

SMILES

CC1(CN(CC2C3)CCN3C1)/C2=N\NC(c1ccncc1)=O

InChI

InChI=1S/C16H21N5O/c1-16-10-20-6-7-21(11-16)9-13(8-20)14(16)18-19-15(22)12-2-4-17-5-3-12/h2-5,13H,6-11H2,1H3,(H,19,22)

InChI Key

ZHHOBFBPINDCCJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01884017

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.348

Distribution Coefficient, logD

0.325

Water Solubility, LogSw

-1.01

Polar Surface Area

50.139

Acid Dissociation Constant (pKa)

10.12

Base Dissociation Constant (pKb)

6.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.30

References: we are preparing a list of scientific research reports with 3414-0074 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3414-0074?
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What is the minimum amount of 3414-0074 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3414-0074
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3414-0074
  • 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 3414-0074 available by request