C798-0153 Screening compound: ethyl 4-[(2-methoxyethyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

C798-0153 Screening compound: ethyl 4-[(2-methoxyethyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
C798-0153 Screening compound: ethyl 4-[(2-methoxyethyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C798-0153
ethyl 4-[(2-methoxyethyl)carbamoyl]-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

C798-0153

Molecular Formula

C13H20N2O4 (C13 H20 N2 O4)

Compound Name

ethyl 4-[(2-methoxyethyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

IUPAC name

ethyl 4-[(2-methoxyethyl)carbamoyl]-35-dimethyl-1H-pyrrole-2-carboxylate

SMILES

CCOC(c1c(C)c(C(NCCOC)=O)c(C)[nH]1)=O

InChI

InChI=1S/C13H20N2O4/c1-5-19-13(17)11-8(2)10(9(3)15-11)12(16)14-6-7-18-4/h15H,5-7H2,1-4H3,(H,14,16)

InChI Key

LFHNUDSAPFLVGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05714206

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

268.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.148

Distribution Coefficient, logD

1.148

Water Solubility, LogSw

-1.16

Polar Surface Area

64.842

Acid Dissociation Constant (pKa)

12.37

Base Dissociation Constant (pKb)

-2.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

References: we are preparing a list of scientific research reports with C798-0153 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C798-0153?
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What is the minimum amount of C798-0153 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C798-0153
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C798-0153
  • 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 C798-0153 available by request