Y502-7413 Screening compound: 1-(methylsulfonyl)-N~4~-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}-4-piperidinecarboxamide

Y502-7413 Screening compound: 1-(methylsulfonyl)-N~4~-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}-4-piperidinecarboxamide
Y502-7413 Screening compound: 1-(methylsulfonyl)-N~4~-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y502-7413
1-(methylsulfonyl)-N~4~-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}-4-piperidinecarboxamide

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

Y502-7413

Molecular Formula

C17H21N5O5S2 (C17 H21 N5 O5 S2)

Compound Name

1-(methylsulfonyl)-N~4~-{4-[(2-pyrimidinylamino)sulfonyl]phenyl}-4-piperidinecarboxamide

IUPAC name

1-methanesulfonyl-N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}piperidine-4-carboxamide

SMILES

CS(N(CC1)CCC1C(Nc(cc1)ccc1S(Nc1ncccn1)(=O)=O)=O)(=O)=O

InChI

InChI=1S/C17H21N5O5S2/c1-28(24,25)22-11-7-13(8-12-22)16(23)20-14-3-5-15(6-4-14)29(26,27)21-17-18-9-2-10-19-17/h2-6,9-10,13H,7-8,11-12H2,1H3,(H,20,23)(H,18,19,21)

InChI Key

OUNSNTBTBVECJE-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.52

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.234

Distribution Coefficient, logD

-0.990

Water Solubility, LogSw

-2.68

Polar Surface Area

116.024

Acid Dissociation Constant (pKa)

6.73

Base Dissociation Constant (pKb)

-1.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.29

References: we are preparing a list of scientific research reports with Y502-7413 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y502-7413?
Check Price and Availability of Y502-7413, 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 Y502-7413 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y502-7413
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y502-7413
  • 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 Y502-7413 available by request