C095-0148 Screening compound: (E)-3-(4-BROMOPHENYL)-N-(4-METHYL-2-MORPHOLINO-6-QUINOLYL)-2-PROPENAMIDE

C095-0148 Screening compound: (E)-3-(4-BROMOPHENYL)-N-(4-METHYL-2-MORPHOLINO-6-QUINOLYL)-2-PROPENAMIDE
C095-0148 Screening compound: (E)-3-(4-BROMOPHENYL)-N-(4-METHYL-2-MORPHOLINO-6-QUINOLYL)-2-PROPENAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C095-0148
(E)-3-(4-BROMOPHENYL)-N-(4-METHYL-2-MORPHOLINO-6-QUINOLYL)-2-PROPENAMIDE

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

C095-0148

Molecular Formula

C23H22BrN3O2 (C23 H22 BrN3 O2)

Compound Name

(E)-3-(4-BROMOPHENYL)-N-(4-METHYL-2-MORPHOLINO-6-QUINOLYL)-2-PROPENAMIDE

IUPAC name

n/a

SMILES

Cc1c(cc(cc2)NC(/C=C/c(cc3)ccc3Br)=O)c2nc(N2CCOCC2)c1

InChI

InChI=1S/C23H22BrN3O2/c1-16-14-22(27-10-12-29-13-11-27)26-21-8-7-19(15-20(16)21)25-23(28)9-4-17-2-5-18(24)6-3-17/h2-9,14-15H,10-13H2,1H3,(H,25,28)

InChI Key

UJFNBDWHOASAAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14719065

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.842

Distribution Coefficient, logD

5.839

Water Solubility, LogSw

-5.56

Polar Surface Area

42.271

Acid Dissociation Constant (pKa)

11.32

Base Dissociation Constant (pKb)

5.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

C095-0148 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C095-0148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C095-0148?
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What is the minimum amount of C095-0148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C095-0148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C095-0148
  • 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 C095-0148 available by request