G798-0103 Screening compound: ethyl 4-{[1-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]formamido]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

G798-0103 Screening compound: ethyl 4-{[1-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]formamido]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
G798-0103 Screening compound: ethyl 4-{[1-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]formamido]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G798-0103
ethyl 4-{[1-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]formamido]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

G798-0103

Molecular Formula

C25H27ClN2O4 (C25 H27 ClN2 O4)

Compound Name

ethyl 4-{[1-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]formamido]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-{[1-(4-chlorophenyl)-N-[(4-methoxyphenyl)methyl]formamido]methyl}-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1c(C)c(CN(Cc(cc2)ccc2OC)C(c(cc2)ccc2Cl)=O)c(C)[nH]1)=O

InChI

InChI=1S/C25H27ClN2O4/c1-5-32-25(30)23-16(2)22(17(3)27-23)15-28(14-18-6-12-21(31-4)13-7-18)24(29)19-8-10-20(26)11-9-19/h6-13,27H,5,14-15H2,1-4H3

InChI Key

WOVBEHPHJYREJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27160281

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.95

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.811

Distribution Coefficient, logD

4.811

Water Solubility, LogSw

-4.91

Polar Surface Area

55.457

Acid Dissociation Constant (pKa)

16.11

Base Dissociation Constant (pKb)

-4.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

References: we are preparing a list of scientific research reports with G798-0103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G798-0103?
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What is the minimum amount of G798-0103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G798-0103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G798-0103
  • 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 G798-0103 available by request