G530-0313 Screening compound: 5-chloro-2-methoxy-N-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}benzene-1-sulfonamide

G530-0313 Screening compound: 5-chloro-2-methoxy-N-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}benzene-1-sulfonamide
G530-0313 Screening compound: 5-chloro-2-methoxy-N-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G530-0313
5-chloro-2-methoxy-N-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}benzene-1-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

G530-0313

Molecular Formula

C21H23ClN2O4S (C21 H23 ClN2 O4 S)

Compound Name

5-chloro-2-methoxy-N-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}benzene-1-sulfonamide

IUPAC name

5-chloro-2-methoxy-N-{[1-(4-methoxyphenyl)-25-dimethyl-1H-pyrrol-3-yl]methyl}benzene-1-sulfonamide

SMILES

Cc1cc(CNS(c(cc(cc2)Cl)c2OC)(=O)=O)c(C)n1-c(cc1)ccc1OC

InChI

InChI=1S/C21H23ClN2O4S/c1-14-11-16(15(2)24(14)18-6-8-19(27-3)9-7-18)13-23-29(25,26)21-12-17(22)5-10-20(21)28-4/h5-12,23H,13H2,1-4H3

InChI Key

BHVYVYZOAMVZDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15016344

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.94

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.116

Distribution Coefficient, logD

4.114

Water Solubility, LogSw

-4.42

Polar Surface Area

59.836

Acid Dissociation Constant (pKa)

9.77

Base Dissociation Constant (pKb)

-3.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

G530-0313 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with G530-0313 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G530-0313?
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What is the minimum amount of G530-0313 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G530-0313
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G530-0313
  • 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 G530-0313 available by request