G799-0166 Screening compound: ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl][(furan-2-yl)methyl]amino}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

G799-0166 Screening compound: ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl][(furan-2-yl)methyl]amino}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
G799-0166 Screening compound: ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl][(furan-2-yl)methyl]amino}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G799-0166
ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl][(furan-2-yl)methyl]amino}methyl)-3,5-dimethyl-1H-pyrrole-2-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

G799-0166

Molecular Formula

C23H26ClN3O4 (C23 H26 ClN3 O4)

Compound Name

ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl][(furan-2-yl)methyl]amino}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-({[(5-chloro-2-methylphenyl)carbamoyl][(furan-2-yl)methyl]amino}methyl)-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1c(C)c(CN(Cc2ccco2)C(Nc2c(C)ccc(Cl)c2)=O)c(C)[nH]1)=O

InChI

InChI=1S/C23H26ClN3O4/c1-5-30-22(28)21-15(3)19(16(4)25-21)13-27(12-18-7-6-10-31-18)23(29)26-20-11-17(24)9-8-14(20)2/h6-11,25H,5,12-13H2,1-4H3,(H,26,29)

InChI Key

HUEXGZJJBMJMAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27160569

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.93

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.016

Distribution Coefficient, logD

5.016

Water Solubility, LogSw

-5.00

Polar Surface Area

63.785

Acid Dissociation Constant (pKa)

12.19

Base Dissociation Constant (pKb)

-2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with G799-0166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G799-0166?
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What is the minimum amount of G799-0166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G799-0166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G799-0166
  • 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 G799-0166 available by request