Y031-1632 Screening compound: N-[2-(butylcarbamoyl)phenyl]-5-chloro-4-acetamido-2-methoxybenzamide

Y031-1632 Screening compound: N-[2-(butylcarbamoyl)phenyl]-5-chloro-4-acetamido-2-methoxybenzamide
Y031-1632 Screening compound: N-[2-(butylcarbamoyl)phenyl]-5-chloro-4-acetamido-2-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-1632
N-[2-(butylcarbamoyl)phenyl]-5-chloro-4-acetamido-2-methoxybenzamide

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

Y031-1632

Molecular Formula

C21H24ClN3O4 (C21 H24 ClN3 O4)

Compound Name

N-[2-(butylcarbamoyl)phenyl]-5-chloro-4-acetamido-2-methoxybenzamide

IUPAC name

N-[2-(butylcarbamoyl)phenyl]-5-chloro-4-acetamido-2-methoxybenzamide

SMILES

CCCCNC(c(cccc1)c1NC(c(c(OC)c1)cc(Cl)c1NC(C)=O)=O)=O

InChI

InChI=1S/C21H24ClN3O4/c1-4-5-10-23-20(27)14-8-6-7-9-17(14)25-21(28)15-11-16(22)18(24-13(2)26)12-19(15)29-3/h6-9,11-12H,4-5,10H2,1-3H3,(H,23,27)(H,24,26)(H,25,28)

InChI Key

RWFMURGRHOEHDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07066897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.89

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.736

Distribution Coefficient, logD

2.745

Water Solubility, LogSw

-4.15

Polar Surface Area

77.353

Acid Dissociation Constant (pKa)

6.46

Base Dissociation Constant (pKb)

-1.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

Y031-1632 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with Y031-1632 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-1632?
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What is the minimum amount of Y031-1632 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-1632
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-1632
  • 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 Y031-1632 available by request