C324-3036 Screening compound: 1-{5-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2,3-dihydro-1H-indol-1-yl}propan-1-one

C324-3036 Screening compound: 1-{5-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2,3-dihydro-1H-indol-1-yl}propan-1-one
C324-3036 Screening compound: 1-{5-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2,3-dihydro-1H-indol-1-yl}propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C324-3036
1-{5-[(3,5-dimethylpiperidin-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

C324-3036

Molecular Formula

C18H26N2O3S (C18 H26 N2 O3 S)

Compound Name

1-{5-[(3,5-dimethylpiperidin-1-yl)sulfonyl]-2,3-dihydro-1H-indol-1-yl}propan-1-one

IUPAC name

1-{5-[(35-dimethylpiperidin-1-yl)sulfonyl]-23-dihydro-1H-indol-1-yl}propan-1-one

SMILES

CCC(N(CC1)c(cc2)c1cc2S(N1CC(C)CC(C)C1)(=O)=O)=O

InChI

InChI=1S/C18H26N2O3S/c1-4-18(21)20-8-7-15-10-16(5-6-17(15)20)24(22,23)19-11-13(2)9-14(3)12-19/h5-6,10,13-14H,4,7-9,11-12H2,1-3H3

InChI Key

CYVXVEHSAJWZTM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05029770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.333

Distribution Coefficient, logD

3.333

Water Solubility, LogSw

-3.81

Polar Surface Area

47.239

Acid Dissociation Constant (pKa)

22.26

Base Dissociation Constant (pKb)

-2.44

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

61.10

C324-3036 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C324-3036 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C324-3036?
Check Price and Availability of C324-3036, 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 C324-3036 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C324-3036
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C324-3036
  • 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 C324-3036 available by request