S751-0824 Screening compound: 1-methyl-N-[2-(5-methyl-2-phenyl-1H-imidazol-1-yl)ethyl]-1H-pyrrole-2-carboxamide

S751-0824 Screening compound: 1-methyl-N-[2-(5-methyl-2-phenyl-1H-imidazol-1-yl)ethyl]-1H-pyrrole-2-carboxamide
S751-0824 Screening compound: 1-methyl-N-[2-(5-methyl-2-phenyl-1H-imidazol-1-yl)ethyl]-1H-pyrrole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S751-0824
1-methyl-N-[2-(5-methyl-2-phenyl-1H-imidazol-1-yl)ethyl]-1H-pyrrole-2-carboxamide

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

S751-0824

Molecular Formula

C18H20N4O (C18 H20 N4 O)

Compound Name

1-methyl-N-[2-(5-methyl-2-phenyl-1H-imidazol-1-yl)ethyl]-1H-pyrrole-2-carboxamide

IUPAC name

1-methyl-N-[2-(5-methyl-2-phenyl-1H-imidazol-1-yl)ethyl]-1H-pyrrole-2-carboxamide

SMILES

Cc1cnc(-c2ccccc2)n1CCNC(c1cccn1C)=O

InChI

InChI=1S/C18H20N4O/c1-14-13-20-17(15-7-4-3-5-8-15)22(14)12-10-19-18(23)16-9-6-11-21(16)2/h3-9,11,13H,10,12H2,1-2H3,(H,19,23)

InChI Key

RQWHPNZHDOPZBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30467849

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.38

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.215

Distribution Coefficient, logD

3.189

Water Solubility, LogSw

-3.12

Polar Surface Area

38.073

Acid Dissociation Constant (pKa)

13.80

Base Dissociation Constant (pKb)

6.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.22

S751-0824 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with S751-0824 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S751-0824?
Check Price and Availability of S751-0824, 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 S751-0824 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S751-0824
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S751-0824
  • 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 S751-0824 available by request