E699-1680 Screening compound: 1-cyclobutanecarbonyl-2-methyl-5-{[4-(morpholine-4-carbonyl)piperidin-1-yl]sulfonyl}-2,3-dihydro-1H-indole

E699-1680 Screening compound: 1-cyclobutanecarbonyl-2-methyl-5-{[4-(morpholine-4-carbonyl)piperidin-1-yl]sulfonyl}-2,3-dihydro-1H-indole
E699-1680 Screening compound: 1-cyclobutanecarbonyl-2-methyl-5-{[4-(morpholine-4-carbonyl)piperidin-1-yl]sulfonyl}-2,3-dihydro-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound E699-1680
1-cyclobutanecarbonyl-2-methyl-5-{[4-(morpholine-4-carbonyl)piperidin-1-yl]sulfonyl}-2,3-dihydro-1H-indole

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

E699-1680

Molecular Formula

C24H33N3O5S (C24 H33 N3 O5 S)

Compound Name

1-cyclobutanecarbonyl-2-methyl-5-{[4-(morpholine-4-carbonyl)piperidin-1-yl]sulfonyl}-2,3-dihydro-1H-indole

IUPAC name

1-cyclobutanecarbonyl-2-methyl-5-{[4-(morpholine-4-carbonyl)piperidin-1-yl]sulfonyl}-23-dihydro-1H-indole

SMILES

CC(C1)N(C(C2CCC2)=O)c(cc2)c1cc2S(N(CC1)CCC1C(N1CCOCC1)=O)(=O)=O

InChI

InChI=1S/C24H33N3O5S/c1-17-15-20-16-21(5-6-22(20)27(17)24(29)18-3-2-4-18)33(30,31)26-9-7-19(8-10-26)23(28)25-11-13-32-14-12-25/h5-6,16-19H,2-4,7-15H2,1H3/t17-/m1/s1

InChI Key

SGMWQSVJNOFEHN-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD14910860

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.61

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

1.585

Distribution Coefficient, logD

1.585

Water Solubility, LogSw

-2.50

Polar Surface Area

71.647

Acid Dissociation Constant (pKa)

22.36

Base Dissociation Constant (pKb)

-1.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.70

E699-1680 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E699-1680 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E699-1680?
Check Price and Availability of E699-1680, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E699-1680 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E699-1680
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E699-1680
  • 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 E699-1680 available by request