L799-1648 Screening compound: 3-ethyl-6-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperidin-1-yl}sulfonyl)-2,3-dihydro-1,3-benzoxazol-2-one

L799-1648 Screening compound: 3-ethyl-6-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperidin-1-yl}sulfonyl)-2,3-dihydro-1,3-benzoxazol-2-one
L799-1648 Screening compound: 3-ethyl-6-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperidin-1-yl}sulfonyl)-2,3-dihydro-1,3-benzoxazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L799-1648
3-ethyl-6-({4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperidin-1-yl}sulfonyl)-2,3-dihydro-1,3-benzoxazol-2-one

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

L799-1648

Molecular Formula

C20H27N3O5S (C20 H27 N3 O5 S)

Compound Name

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

IUPAC name

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

SMILES

CCN(c(ccc(S(N1CCC(CC(N2CCCC2)=O)CC1)(=O)=O)c1)c1O1)C1=O

InChI

InChI=1S/C20H27N3O5S/c1-2-23-17-6-5-16(14-18(17)28-20(23)25)29(26,27)22-11-7-15(8-12-22)13-19(24)21-9-3-4-10-21/h5-6,14-15H,2-4,7-13H2,1H3

InChI Key

ROGGIKIXRUXRJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27475743

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.418

Distribution Coefficient, logD

2.418

Water Solubility, LogSw

-2.93

Polar Surface Area

71.261

Acid Dissociation Constant (pKa)

24.23

Base Dissociation Constant (pKb)

-1.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

References: we are preparing a list of scientific research reports with L799-1648 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L799-1648?
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What is the minimum amount of L799-1648 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L799-1648
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L799-1648
  • 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 L799-1648 available by request