V018-3395 Screening compound: ethyl 1-ethyl-6-[(4-ethylpiperazino)methyl]-4-(4-isopropylphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

V018-3395 Screening compound: ethyl 1-ethyl-6-[(4-ethylpiperazino)methyl]-4-(4-isopropylphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
V018-3395 Screening compound: ethyl 1-ethyl-6-[(4-ethylpiperazino)methyl]-4-(4-isopropylphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-3395
ethyl 1-ethyl-6-[(4-ethylpiperazino)methyl]-4-(4-isopropylphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

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

V018-3395

Molecular Formula

C25H38N4O3 (C25 H38 N4 O3)

Compound Name

ethyl 1-ethyl-6-[(4-ethylpiperazino)methyl]-4-(4-isopropylphenyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

IUPAC name

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

SMILES

CCN1CCN(CC(N(CC)C(NC2c3ccc(C(C)C)cc3)=O)=C2C(OCC)=O)CC1

InChI

InChI=1S/C25H38N4O3/c1-6-27-13-15-28(16-14-27)17-21-22(24(30)32-8-3)23(26-25(31)29(21)7-2)20-11-9-19(10-12-20)18(4)5/h9-12,18,23H,6-8,13-17H2,1-5H3,(H,26,31)/t23-/m1/s1

InChI Key

BHJGZLKUHASDAL-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19812221

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

442.6

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.508

Distribution Coefficient, logD

2.088

Water Solubility, LogSw

-3.35

Polar Surface Area

56.018

Acid Dissociation Constant (pKa)

9.66

Base Dissociation Constant (pKb)

8.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

References: we are preparing a list of scientific research reports with V018-3395 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-3395?
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What is the minimum amount of V018-3395 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-3395
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-3395
  • 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 V018-3395 available by request