G070-1620 Screening compound: ethyl 2,5-dimethyl-4-({[(4-sulfamoylphenyl)carbamoyl]methyl}sulfamoyl)-1H-pyrrole-3-carboxylate

G070-1620 Screening compound: ethyl 2,5-dimethyl-4-({[(4-sulfamoylphenyl)carbamoyl]methyl}sulfamoyl)-1H-pyrrole-3-carboxylate
G070-1620 Screening compound: ethyl 2,5-dimethyl-4-({[(4-sulfamoylphenyl)carbamoyl]methyl}sulfamoyl)-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G070-1620
ethyl 2,5-dimethyl-4-({[(4-sulfamoylphenyl)carbamoyl]methyl}sulfamoyl)-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

G070-1620

Molecular Formula

C17H22N4O7S2 (C17 H22 N4 O7 S2)

Compound Name

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

IUPAC name

ethyl 25-dimethyl-4-({[(4-sulfamoylphenyl)carbamoyl]methyl}sulfamoyl)-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(C)c1S(NCC(Nc(cc1)ccc1S(N)(=O)=O)=O)(=O)=O)=O

InChI

InChI=1S/C17H22N4O7S2/c1-4-28-17(23)15-10(2)20-11(3)16(15)30(26,27)19-9-14(22)21-12-5-7-13(8-6-12)29(18,24)25/h5-8,19-20H,4,9H2,1-3H3,(H,21,22)(H2,18,24,25)

InChI Key

KODLQXTWGZWJKS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14978994

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.52

Hydrogen Bond Acceptors Count

15.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.199

Distribution Coefficient, logD

0.196

Water Solubility, LogSw

-2.00

Polar Surface Area

147.291

Acid Dissociation Constant (pKa)

9.58

Base Dissociation Constant (pKb)

-2.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

G070-1620 in Drug Discovery

Included in Screening Libraries

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

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with G070-1620 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G070-1620?
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What is the minimum amount of G070-1620 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G070-1620
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G070-1620
  • 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 G070-1620 available by request