Y300-0414 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-2,5-dimethylbenzene-1-sulfonamide

Y300-0414 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-2,5-dimethylbenzene-1-sulfonamide
Y300-0414 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-2,5-dimethylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y300-0414
N-{[4-(dimethylamino)phenyl]methyl}-2,5-dimethylbenzene-1-sulfonamide

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

Y300-0414

Molecular Formula

C17H22N2O2S (C17 H22 N2 O2 S)

Compound Name

N-{[4-(dimethylamino)phenyl]methyl}-2,5-dimethylbenzene-1-sulfonamide

IUPAC name

N-{[4-(dimethylamino)phenyl]methyl}-25-dimethylbenzene-1-sulfonamide

SMILES

Cc1cc(S(NCc(cc2)ccc2N(C)C)(=O)=O)c(C)cc1

InChI

InChI=1S/C17H22N2O2S/c1-13-5-6-14(2)17(11-13)22(20,21)18-12-15-7-9-16(10-8-15)19(3)4/h5-11,18H,12H2,1-4H3

InChI Key

GKQAFJQNDOQDOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15565629

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.716

Distribution Coefficient, logD

3.705

Water Solubility, LogSw

-3.79

Polar Surface Area

44.801

Acid Dissociation Constant (pKa)

10.19

Base Dissociation Constant (pKb)

5.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

Y300-0414 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer

References: we are preparing a list of scientific research reports with Y300-0414 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y300-0414?
Check Price and Availability of Y300-0414, 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 Y300-0414 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y300-0414
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y300-0414
  • 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 Y300-0414 available by request