6048-0629 Screening compound: methyl N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}carbamate

6048-0629 Screening compound: methyl N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}carbamate
6048-0629 Screening compound: methyl N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6048-0629
methyl N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}carbamate

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

6048-0629

Molecular Formula

C12H12N4O4S (C12 H12 N4 O4 S)

Compound Name

methyl N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}carbamate

IUPAC name

methyl N-{4-[(pyrimidin-2-yl)sulfamoyl]phenyl}carbamate

SMILES

COC(Nc(cc1)ccc1S(Nc1ncccn1)(=O)=O)=O

InChI

InChI=1S/C12H12N4O4S/c1-20-12(17)15-9-3-5-10(6-4-9)21(18,19)16-11-13-7-2-8-14-11/h2-8H,1H3,(H,15,17)(H,13,14,16)

InChI Key

UBWGKESGQORLBW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03389077

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.32

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.604

Distribution Coefficient, logD

-0.151

Water Solubility, LogSw

-2.72

Polar Surface Area

93.322

Acid Dissociation Constant (pKa)

6.73

Base Dissociation Constant (pKb)

-1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

6048-0629 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
Targets:
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6048-0629 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6048-0629?
Check Price and Availability of 6048-0629, 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 6048-0629 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6048-0629
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6048-0629
  • 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 6048-0629 available by request