L799-1712 Screening compound: 2-{1-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl}-N-[(4-fluorophenyl)methyl]acetamide

L799-1712 Screening compound: 2-{1-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl}-N-[(4-fluorophenyl)methyl]acetamide
L799-1712 Screening compound: 2-{1-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl}-N-[(4-fluorophenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L799-1712
2-{1-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl}-N-[(4-fluorophenyl)methyl]acetamide

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

L799-1712

Molecular Formula

C23H26FN3O5S (C23 H26 FN3 O5 S)

Compound Name

2-{1-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl}-N-[(4-fluorophenyl)methyl]acetamide

IUPAC name

2-{1-[(3-ethyl-2-oxo-23-dihydro-13-benzoxazol-6-yl)sulfonyl]piperidin-4-yl}-N-[(4-fluorophenyl)methyl]acetamide

SMILES

CCN(c(ccc(S(N1CCC(CC(NCc(cc2)ccc2F)=O)CC1)(=O)=O)c1)c1O1)C1=O

InChI

InChI=1S/C23H26FN3O5S/c1-2-27-20-8-7-19(14-21(20)32-23(27)29)33(30,31)26-11-9-16(10-12-26)13-22(28)25-15-17-3-5-18(24)6-4-17/h3-8,14,16H,2,9-13,15H2,1H3,(H,25,28)

InChI Key

SSVGOCBYBPOLKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27475763

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.021

Distribution Coefficient, logD

3.021

Water Solubility, LogSw

-3.58

Polar Surface Area

78.974

Acid Dissociation Constant (pKa)

12.40

Base Dissociation Constant (pKb)

-2.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with L799-1712 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L799-1712?
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What is the minimum amount of L799-1712 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L799-1712
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L799-1712
  • 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 L799-1712 available by request