G793-0690 Screening compound: ethyl 4-{2-[(butan-2-yl)carbamoyl]ethyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate

G793-0690 Screening compound: ethyl 4-{2-[(butan-2-yl)carbamoyl]ethyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
G793-0690 Screening compound: ethyl 4-{2-[(butan-2-yl)carbamoyl]ethyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G793-0690
ethyl 4-{2-[(butan-2-yl)carbamoyl]ethyl}-1,3,5-trimethyl-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

G793-0690

Molecular Formula

C17H28N2O3 (C17 H28 N2 O3)

Compound Name

ethyl 4-{2-[(butan-2-yl)carbamoyl]ethyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-{2-[(butan-2-yl)carbamoyl]ethyl}-135-trimethyl-1H-pyrrole-2-carboxylate

SMILES

CCC(C)NC(CCc1c(C)n(C)c(C(OCC)=O)c1C)=O

InChI

InChI=1S/C17H28N2O3/c1-7-11(3)18-15(20)10-9-14-12(4)16(17(21)22-8-2)19(6)13(14)5/h11H,7-10H2,1-6H3,(H,18,20)/t11-/m0/s1

InChI Key

MBNFCCIGJAHAKL-NSHDSACASA-N

MDL Number (MFCD)

MFCD27643621

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.350

Distribution Coefficient, logD

2.350

Water Solubility, LogSw

-2.20

Polar Surface Area

46.713

Acid Dissociation Constant (pKa)

15.47

Base Dissociation Constant (pKb)

-0.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

64.70

G793-0690 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G793-0690 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G793-0690?
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What is the minimum amount of G793-0690 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G793-0690
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G793-0690
  • 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 G793-0690 available by request