Y300-3891 Screening compound: N-(4-{[1-(2,3-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]oxy}phenyl)-N-methylmethanesulfonamide

Y300-3891 Screening compound: N-(4-{[1-(2,3-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]oxy}phenyl)-N-methylmethanesulfonamide
Y300-3891 Screening compound: N-(4-{[1-(2,3-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]oxy}phenyl)-N-methylmethanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y300-3891
N-(4-{[1-(2,3-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]oxy}phenyl)-N-methylmethanesulfonamide

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

Y300-3891

Molecular Formula

C19H22N2O4S (C19 H22 N2 O4 S)

Compound Name

N-(4-{[1-(2,3-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]oxy}phenyl)-N-methylmethanesulfonamide

IUPAC name

N-(4-{[1-(23-dihydro-1H-indol-1-yl)-1-oxopropan-2-yl]oxy}phenyl)-N-methylmethanesulfonamide

SMILES

CC(C(N(CC1)c2c1cccc2)=O)Oc(cc1)ccc1N(C)S(C)(=O)=O

InChI

InChI=1S/C19H22N2O4S/c1-14(19(22)21-13-12-15-6-4-5-7-18(15)21)25-17-10-8-16(9-11-17)20(2)26(3,23)24/h4-11,14H,12-13H2,1-3H3/t14-/m0/s1

InChI Key

UWDWAHBTXWUMFI-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD20504274

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.639

Distribution Coefficient, logD

2.639

Water Solubility, LogSw

-3.15

Polar Surface Area

55.291

Acid Dissociation Constant (pKa)

21.03

Base Dissociation Constant (pKb)

0.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

Y300-3891 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y300-3891 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y300-3891?
Check Price and Availability of Y300-3891, 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 Y300-3891 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y300-3891
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y300-3891
  • 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 Y300-3891 available by request