C259-1172 Screening compound: 1-(5-bromo-6-{[3-(2-methyl-2,3-dihydro-1H-indole-1-carbonyl)piperidin-1-yl]sulfonyl}-2,3-dihydro-1H-indol-1-yl)propan-1-one

C259-1172 Screening compound: 1-(5-bromo-6-{[3-(2-methyl-2,3-dihydro-1H-indole-1-carbonyl)piperidin-1-yl]sulfonyl}-2,3-dihydro-1H-indol-1-yl)propan-1-one
C259-1172 Screening compound: 1-(5-bromo-6-{[3-(2-methyl-2,3-dihydro-1H-indole-1-carbonyl)piperidin-1-yl]sulfonyl}-2,3-dihydro-1H-indol-1-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C259-1172
1-(5-bromo-6-{[3-(2-methyl-2,3-dihydro-1H-indole-1-carbonyl)piperidin-1-yl]sulfonyl}-2,3-dihydro-1H-indol-1-yl)propan-1-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

C259-1172

Molecular Formula

C26H30BrN3O4S (C26 H30 BrN3 O4 S)

Compound Name

1-(5-bromo-6-{[3-(2-methyl-2,3-dihydro-1H-indole-1-carbonyl)piperidin-1-yl]sulfonyl}-2,3-dihydro-1H-indol-1-yl)propan-1-one

IUPAC name

1-(5-bromo-6-{[3-(2-methyl-23-dihydro-1H-indole-1-carbonyl)piperidin-1-yl]sulfonyl}-23-dihydro-1H-indol-1-yl)propan-1-one

SMILES

CCC(N(CCc1c2)c1cc(S(N(CCC1)CC1C(N(C(C)C1)c3c1cccc3)=O)(=O)=O)c2Br)=O

InChI

InChI=1S/C26H30BrN3O4S/c1-3-25(31)29-12-10-19-14-21(27)24(15-23(19)29)35(33,34)28-11-6-8-20(16-28)26(32)30-17(2)13-18-7-4-5-9-22(18)30/h4-5,7,9,14-15,17,20H,3,6,8,10-13,16H2,1-2H3

InChI Key

VHZGBVWOTYLIOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14737187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

560.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.941

Distribution Coefficient, logD

3.941

Water Solubility, LogSw

-4.00

Polar Surface Area

61.923

Acid Dissociation Constant (pKa)

21.72

Base Dissociation Constant (pKb)

-1.23

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

46.15

C259-1172 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C259-1172 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C259-1172?
Check Price and Availability of C259-1172, 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 C259-1172 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C259-1172
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C259-1172
  • 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 C259-1172 available by request