D170-0271 Screening compound: N-(2-acetamido-5-methylphenyl)-1-phenylcyclopentane-1-carboxamide

D170-0271 Screening compound: N-(2-acetamido-5-methylphenyl)-1-phenylcyclopentane-1-carboxamide
D170-0271 Screening compound: N-(2-acetamido-5-methylphenyl)-1-phenylcyclopentane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D170-0271
N-(2-acetamido-5-methylphenyl)-1-phenylcyclopentane-1-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

D170-0271

Molecular Formula

C21H24N2O2 (C21 H24 N2 O2)

Compound Name

N-(2-acetamido-5-methylphenyl)-1-phenylcyclopentane-1-carboxamide

IUPAC name

N-(2-acetamido-5-methylphenyl)-1-phenylcyclopentane-1-carboxamide

SMILES

CC(Nc(ccc(C)c1)c1NC(C1(CCCC1)c1ccccc1)=O)=O

InChI

InChI=1S/C21H24N2O2/c1-15-10-11-18(22-16(2)24)19(14-15)23-20(25)21(12-6-7-13-21)17-8-4-3-5-9-17/h3-5,8-11,14H,6-7,12-13H2,1-2H3,(H,22,24)(H,23,25)

InChI Key

DMMHXJBGBMRGBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14813490

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.213

Distribution Coefficient, logD

3.111

Water Solubility, LogSw

-3.40

Polar Surface Area

45.482

Acid Dissociation Constant (pKa)

7.98

Base Dissociation Constant (pKb)

1.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

D170-0271 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 D170-0271 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D170-0271?
Check Price and Availability of D170-0271, 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 D170-0271 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D170-0271
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D170-0271
  • 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 D170-0271 available by request