L799-1630 Screening compound: 2-{1-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl}-N-(3-fluorophenyl)acetamide

L799-1630 Screening compound: 2-{1-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl}-N-(3-fluorophenyl)acetamide
L799-1630 Screening compound: 2-{1-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl}-N-(3-fluorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L799-1630
2-{1-[(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]piperidin-4-yl}-N-(3-fluorophenyl)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

L799-1630

Molecular Formula

C22H24FN3O5S (C22 H24 FN3 O5 S)

Compound Name

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

IUPAC name

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

SMILES

CCN(c(ccc(S(N1CCC(CC(Nc2cc(F)ccc2)=O)CC1)(=O)=O)c1)c1O1)C1=O

InChI

InChI=1S/C22H24FN3O5S/c1-2-26-19-7-6-18(14-20(19)31-22(26)28)32(29,30)25-10-8-15(9-11-25)12-21(27)24-17-5-3-4-16(23)13-17/h3-7,13-15H,2,8-12H2,1H3,(H,24,27)

InChI Key

VGNABQTULUPXPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27475734

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.51

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.530

Distribution Coefficient, logD

3.529

Water Solubility, LogSw

-4.03

Polar Surface Area

77.652

Acid Dissociation Constant (pKa)

10.45

Base Dissociation Constant (pKb)

-0.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with L799-1630 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L799-1630?
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What is the minimum amount of L799-1630 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L799-1630
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L799-1630
  • 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 L799-1630 available by request