C737-0435 Screening compound: N-[(4-METHOXYPHENYL)METHYL]-3-PHENYL-2-(1H-PYRROL-1-YL)PROPANAMIDE

C737-0435 Screening compound: N-[(4-METHOXYPHENYL)METHYL]-3-PHENYL-2-(1H-PYRROL-1-YL)PROPANAMIDE
C737-0435 Screening compound: N-[(4-METHOXYPHENYL)METHYL]-3-PHENYL-2-(1H-PYRROL-1-YL)PROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C737-0435
N-[(4-METHOXYPHENYL)METHYL]-3-PHENYL-2-(1H-PYRROL-1-YL)PROPANAMIDE

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

C737-0435

Molecular Formula

C21H22N2O2 (C21 H22 N2 O2)

Compound Name

N-[(4-METHOXYPHENYL)METHYL]-3-PHENYL-2-(1H-PYRROL-1-YL)PROPANAMIDE

IUPAC name

N-[(4-methoxyphenyl)methyl]-3-phenyl-2-(1H-pyrrol-1-yl)propanamide

SMILES

COc1ccc(CNC(C(Cc2ccccc2)n2cccc2)=O)cc1

InChI

InChI=1S/C21H22N2O2/c1-25-19-11-9-18(10-12-19)16-22-21(24)20(23-13-5-6-14-23)15-17-7-3-2-4-8-17/h2-14,20H,15-16H2,1H3,(H,22,24)/t20-/m0/s1

InChI Key

RJSLHBRUAVLMDZ-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD14790168

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.785

Distribution Coefficient, logD

3.785

Water Solubility, LogSw

-4.03

Polar Surface Area

35.718

Acid Dissociation Constant (pKa)

13.06

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

C737-0435 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C737-0435 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C737-0435?
Check Price and Availability of C737-0435, 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 C737-0435 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C737-0435
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C737-0435
  • 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 C737-0435 available by request