G070-0639 Screening compound: ethyl 4-({[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]methyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

G070-0639 Screening compound: ethyl 4-({[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]methyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
G070-0639 Screening compound: ethyl 4-({[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]methyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G070-0639
ethyl 4-({[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]methyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

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

G070-0639

Molecular Formula

C19H22N4O6S2 (C19 H22 N4 O6 S2)

Compound Name

ethyl 4-({[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]methyl}sulfamoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 4-({[(6-methoxy-13-benzothiazol-2-yl)carbamoyl]methyl}sulfamoyl)-25-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(C)c1S(NCC(Nc1nc(ccc(OC)c2)c2s1)=O)(=O)=O)=O

InChI

InChI=1S/C19H22N4O6S2/c1-5-29-18(25)16-10(2)21-11(3)17(16)31(26,27)20-9-15(24)23-19-22-13-7-6-12(28-4)8-14(13)30-19/h6-8,20-21H,5,9H2,1-4H3,(H,22,23,24)

InChI Key

JJYOQNMWJWJUAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14978698

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.54

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.665

Distribution Coefficient, logD

2.650

Water Solubility, LogSw

-3.23

Polar Surface Area

113.993

Acid Dissociation Constant (pKa)

8.86

Base Dissociation Constant (pKb)

0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

G070-0639 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G070-0639 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G070-0639?
Check Price and Availability of G070-0639, 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 G070-0639 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G070-0639
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G070-0639
  • 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 G070-0639 available by request