D668-0357 Screening compound: 2-hydroxy-4-methyl-N-[2-(morpholin-4-yl)ethyl]-6-oxo-1,6-dihydropyrimidine-5-sulfonamide

D668-0357 Screening compound: 2-hydroxy-4-methyl-N-[2-(morpholin-4-yl)ethyl]-6-oxo-1,6-dihydropyrimidine-5-sulfonamide
D668-0357 Screening compound: 2-hydroxy-4-methyl-N-[2-(morpholin-4-yl)ethyl]-6-oxo-1,6-dihydropyrimidine-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D668-0357
2-hydroxy-4-methyl-N-[2-(morpholin-4-yl)ethyl]-6-oxo-1,6-dihydropyrimidine-5-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

D668-0357

Molecular Formula

C11H18N4O5S (C11 H18 N4 O5 S)

Compound Name

2-hydroxy-4-methyl-N-[2-(morpholin-4-yl)ethyl]-6-oxo-1,6-dihydropyrimidine-5-sulfonamide

IUPAC name

2-hydroxy-4-methyl-N-[2-(morpholin-4-yl)ethyl]-6-oxo-16-dihydropyrimidine-5-sulfonamide

SMILES

CC(N=C(NC1=O)O)=C1S(NCCN1CCOCC1)(=O)=O

InChI

InChI=1S/C11H18N4O5S/c1-8-9(10(16)14-11(17)13-8)21(18,19)12-2-3-15-4-6-20-7-5-15/h12H,2-7H2,1H3,(H2,13,14,16,17)

InChI Key

CWBZRZHCILPDHT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27595494

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.35

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-1.990

Distribution Coefficient, logD

-8.627

Water Solubility, LogSw

-1.45

Polar Surface Area

105.510

Acid Dissociation Constant (pKa)

0.76

Base Dissociation Constant (pKb)

5.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.60

D668-0357 in Drug Discovery

Included in Screening Libraries

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

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D668-0357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D668-0357?
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What is the minimum amount of D668-0357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D668-0357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D668-0357
  • 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 D668-0357 available by request