Y600-1273 Screening compound: N-{4-[({4-[(E)-2-(3,4-dimethoxyphenyl)-1-ethenyl]-2-pyrimidinyl}amino)sulfonyl]phenyl}hexanamide

Y600-1273 Screening compound: N-{4-[({4-[(E)-2-(3,4-dimethoxyphenyl)-1-ethenyl]-2-pyrimidinyl}amino)sulfonyl]phenyl}hexanamide
Y600-1273 Screening compound: N-{4-[({4-[(E)-2-(3,4-dimethoxyphenyl)-1-ethenyl]-2-pyrimidinyl}amino)sulfonyl]phenyl}hexanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y600-1273
N-{4-[({4-[(E)-2-(3,4-dimethoxyphenyl)-1-ethenyl]-2-pyrimidinyl}amino)sulfonyl]phenyl}hexanamide

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

Y600-1273

Molecular Formula

C26H30N4O5S (C26 H30 N4 O5 S)

Compound Name

N-{4-[({4-[(E)-2-(3,4-dimethoxyphenyl)-1-ethenyl]-2-pyrimidinyl}amino)sulfonyl]phenyl}hexanamide

IUPAC name

N-[4-({4-[(1E)-2-(34-dimethoxyphenyl)ethenyl]pyrimidin-2-yl}sulfamoyl)phenyl]hexanamide

SMILES

CCCCCC(Nc(cc1)ccc1S(Nc1nc(/C=C/c(cc2)cc(OC)c2OC)ccn1)(=O)=O)=O

InChI

InChI=1S/C26H30N4O5S/c1-4-5-6-7-25(31)28-20-11-13-22(14-12-20)36(32,33)30-26-27-17-16-21(29-26)10-8-19-9-15-23(34-2)24(18-19)35-3/h8-18H,4-7H2,1-3H3,(H,28,31)(H,27,29,30)

InChI Key

ABYOVYKHAORECF-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.61

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.543

Distribution Coefficient, logD

3.618

Water Solubility, LogSw

-4.40

Polar Surface Area

99.659

Acid Dissociation Constant (pKa)

6.53

Base Dissociation Constant (pKb)

-1.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.92

Y600-1273 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y600-1273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y600-1273?
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What is the minimum amount of Y600-1273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y600-1273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y600-1273
  • 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 Y600-1273 available by request