F943-1331 Screening compound: ethyl 1-({3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl}sulfonyl)piperidine-3-carboxylate

F943-1331 Screening compound: ethyl 1-({3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl}sulfonyl)piperidine-3-carboxylate
F943-1331 Screening compound: ethyl 1-({3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl}sulfonyl)piperidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F943-1331
ethyl 1-({3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl}sulfonyl)piperidine-3-carboxylate

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

F943-1331

Molecular Formula

C21H27N3O7S2 (C21 H27 N3 O7 S2)

Compound Name

ethyl 1-({3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-2,3-dihydro-1,3-benzothiazol-6-yl}sulfonyl)piperidine-3-carboxylate

IUPAC name

ethyl 1-({3-[2-(morpholin-4-yl)-2-oxoethyl]-2-oxo-23-dihydro-13-benzothiazol-6-yl}sulfonyl)piperidine-3-carboxylate

SMILES

CCOC(C(CCC1)CN1S(c(cc1)cc(S2)c1N(CC(N1CCOCC1)=O)C2=O)(=O)=O)=O

InChI

InChI=1S/C21H27N3O7S2/c1-2-31-20(26)15-4-3-7-23(13-15)33(28,29)16-5-6-17-18(12-16)32-21(27)24(17)14-19(25)22-8-10-30-11-9-22/h5-6,12,15H,2-4,7-11,13-14H2,1H3/t15-/m0/s1

InChI Key

HAWQXPDHHMYWNB-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27205292

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.59

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.425

Distribution Coefficient, logD

1.425

Water Solubility, LogSw

-2.57

Polar Surface Area

92.510

Acid Dissociation Constant (pKa)

21.85

Base Dissociation Constant (pKb)

-0.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.10

References: we are preparing a list of scientific research reports with F943-1331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F943-1331?
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What is the minimum amount of F943-1331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F943-1331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F943-1331
  • 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 F943-1331 available by request