C174-0203 Screening compound: N-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methyl}acetamide

C174-0203 Screening compound: N-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methyl}acetamide
C174-0203 Screening compound: N-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C174-0203
N-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methyl}acetamide

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

C174-0203

Molecular Formula

C13H15N3O (C13 H15 N3 O)

Compound Name

N-{[1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methyl}acetamide

IUPAC name

N-{[1-(prop-2-en-1-yl)-1H-13-benzodiazol-2-yl]methyl}acetamide

SMILES

CC(NCc1nc(cccc2)c2n1CC=C)=O

InChI

InChI=1S/C13H15N3O/c1-3-8-16-12-7-5-4-6-11(12)15-13(16)9-14-10(2)17/h3-7H,1,8-9H2,2H3,(H,14,17)

InChI Key

MBBIMQBXOBGJLF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04458945

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

229.28

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.330

Distribution Coefficient, logD

1.330

Water Solubility, LogSw

-1.77

Polar Surface Area

35.977

Acid Dissociation Constant (pKa)

12.23

Base Dissociation Constant (pKb)

4.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

C174-0203 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C174-0203 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C174-0203?
Check Price and Availability of C174-0203, 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 C174-0203 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C174-0203
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C174-0203
  • 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 C174-0203 available by request