C153-0219 Screening compound: N-[(4-fluorophenyl)methyl]-3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]-1-benzofuran-2-carboxamide

C153-0219 Screening compound: N-[(4-fluorophenyl)methyl]-3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]-1-benzofuran-2-carboxamide
C153-0219 Screening compound: N-[(4-fluorophenyl)methyl]-3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C153-0219
N-[(4-fluorophenyl)methyl]-3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]-1-benzofuran-2-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

C153-0219

Molecular Formula

C23H25FN2O4S (C23 H25 FN2 O4 S)

Compound Name

N-[(4-fluorophenyl)methyl]-3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]-1-benzofuran-2-carboxamide

IUPAC name

N-[(4-fluorophenyl)methyl]-3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]-1-benzofuran-2-carboxamide

SMILES

CC(CC1)CCN1S(c(cc1)cc2c1oc(C(NCc(cc1)ccc1F)=O)c2C)(=O)=O

InChI

InChI=1S/C23H25FN2O4S/c1-15-9-11-26(12-10-15)31(28,29)19-7-8-21-20(13-19)16(2)22(30-21)23(27)25-14-17-3-5-18(24)6-4-17/h3-8,13,15H,9-12,14H2,1-2H3,(H,25,27)

InChI Key

JMKMEDRXKRPMHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14723083

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.523

Distribution Coefficient, logD

4.523

Water Solubility, LogSw

-4.20

Polar Surface Area

64.889

Acid Dissociation Constant (pKa)

10.99

Base Dissociation Constant (pKb)

-1.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with C153-0219 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C153-0219?
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What is the minimum amount of C153-0219 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C153-0219
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C153-0219
  • 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 C153-0219 available by request