1488-1037 Screening compound: N-methyl-N-(4-methylbenzenesulfonyl)-1-{[(4-methylbenzenesulfonyl)carbamoyl]amino}formamide

1488-1037 Screening compound: N-methyl-N-(4-methylbenzenesulfonyl)-1-{[(4-methylbenzenesulfonyl)carbamoyl]amino}formamide
1488-1037 Screening compound: N-methyl-N-(4-methylbenzenesulfonyl)-1-{[(4-methylbenzenesulfonyl)carbamoyl]amino}formamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1488-1037
N-methyl-N-(4-methylbenzenesulfonyl)-1-{[(4-methylbenzenesulfonyl)carbamoyl]amino}formamide

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

1488-1037

Molecular Formula

C17H19N3O6S2 (C17 H19 N3 O6 S2)

Compound Name

N-methyl-N-(4-methylbenzenesulfonyl)-1-{[(4-methylbenzenesulfonyl)carbamoyl]amino}formamide

IUPAC name

N-methyl-N-(4-methylbenzenesulfonyl)-1-{[(4-methylbenzenesulfonyl)carbamoyl]amino}formamide

SMILES

Cc(cc1)ccc1S(NC(NC(N(C)S(c1ccc(C)cc1)(=O)=O)=O)=O)(=O)=O

InChI

InChI=1S/C17H19N3O6S2/c1-12-4-8-14(9-5-12)27(23,24)19-16(21)18-17(22)20(3)28(25,26)15-10-6-13(2)7-11-15/h4-11H,1-3H3,(H2,18,19,21,22)

InChI Key

KWZTZVISLZSOAX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01536917

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.49

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.772

Distribution Coefficient, logD

-2.360

Water Solubility, LogSw

-3.43

Polar Surface Area

110.204

Acid Dissociation Constant (pKa)

2.27

Base Dissociation Constant (pKb)

-11.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

1488-1037 in Drug Discovery

Included in Screening Libraries

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

Dark Chemical Matter Library (18430 compounds)

Frequent Hitters Library (7624 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 1488-1037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1488-1037?
Check Price and Availability of 1488-1037, 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 1488-1037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1488-1037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1488-1037
  • 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 1488-1037 available by request