E611-0049 Screening compound: ethyl 6-[(4-ethylpiperazin-1-yl)methyl]-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

E611-0049 Screening compound: ethyl 6-[(4-ethylpiperazin-1-yl)methyl]-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
E611-0049 Screening compound: ethyl 6-[(4-ethylpiperazin-1-yl)methyl]-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E611-0049
ethyl 6-[(4-ethylpiperazin-1-yl)methyl]-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-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

E611-0049

Molecular Formula

C21H30N4O4 (C21 H30 N4 O4)

Compound Name

ethyl 6-[(4-ethylpiperazin-1-yl)methyl]-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

ethyl 6-[(4-ethylpiperazin-1-yl)methyl]-4-(4-methoxyphenyl)-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCN1CCN(CC(NC(NC2c(cc3)ccc3OC)=O)=C2C(OCC)=O)CC1

InChI

InChI=1S/C21H30N4O4/c1-4-24-10-12-25(13-11-24)14-17-18(20(26)29-5-2)19(23-21(27)22-17)15-6-8-16(28-3)9-7-15/h6-9,19H,4-5,10-14H2,1-3H3,(H2,22,23,27)/t19-/m1/s1

InChI Key

MVXTWFUNIQUEJZ-LJQANCHMSA-N

MDL Number (MFCD)

MFCD14903261

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.273

Distribution Coefficient, logD

1.273

Water Solubility, LogSw

-2.14

Polar Surface Area

71.865

Acid Dissociation Constant (pKa)

6.55

Base Dissociation Constant (pKb)

9.74

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.40

References: we are preparing a list of scientific research reports with E611-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E611-0049?
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What is the minimum amount of E611-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E611-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E611-0049
  • 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 E611-0049 available by request