P091-0076 Screening compound: N-[(4-chlorophenyl)methyl]-3-(1-methyl-1H-indol-5-yl)propanamide

P091-0076 Screening compound: N-[(4-chlorophenyl)methyl]-3-(1-methyl-1H-indol-5-yl)propanamide
P091-0076 Screening compound: N-[(4-chlorophenyl)methyl]-3-(1-methyl-1H-indol-5-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P091-0076
N-[(4-chlorophenyl)methyl]-3-(1-methyl-1H-indol-5-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

P091-0076

Molecular Formula

C19H19ClN2O (C19 H19 ClN2 O)

Compound Name

N-[(4-chlorophenyl)methyl]-3-(1-methyl-1H-indol-5-yl)propanamide

IUPAC name

N-[(4-chlorophenyl)methyl]-3-(1-methyl-1H-indol-5-yl)propanamide

SMILES

Cn(cc1)c2c1cc(CCC(NCc(cc1)ccc1Cl)=O)cc2

InChI

InChI=1S/C19H19ClN2O/c1-22-11-10-16-12-14(4-8-18(16)22)5-9-19(23)21-13-15-2-6-17(20)7-3-15/h2-4,6-8,10-12H,5,9,13H2,1H3,(H,21,23)

InChI Key

NGBFIKNUQXKYTF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27563760

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.83

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.034

Distribution Coefficient, logD

4.034

Water Solubility, LogSw

-4.33

Polar Surface Area

27.105

Acid Dissociation Constant (pKa)

12.18

Base Dissociation Constant (pKb)

-2.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

P091-0076 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P091-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P091-0076?
Check Price and Availability of P091-0076, 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 P091-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P091-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P091-0076
  • 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 P091-0076 available by request