V010-8393 Screening compound: ethyl 1-butyl-4-[3-(4-methoxybenzamido)phenyl]-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V010-8393 Screening compound: ethyl 1-butyl-4-[3-(4-methoxybenzamido)phenyl]-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V010-8393 Screening compound: ethyl 1-butyl-4-[3-(4-methoxybenzamido)phenyl]-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-8393
ethyl 1-butyl-4-[3-(4-methoxybenzamido)phenyl]-2-oxo-6-phenyl-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

V010-8393

Molecular Formula

C31H33N3O5 (C31 H33 N3 O5)

Compound Name

ethyl 1-butyl-4-[3-(4-methoxybenzamido)phenyl]-2-oxo-6-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

ethyl 1-butyl-4-[3-(4-methoxybenzamido)phenyl]-2-oxo-6-phenyl-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCCCN(C(c1ccccc1)=C(C(c1cc(NC(c(cc2)ccc2OC)=O)ccc1)N1)C(OCC)=O)C1=O

InChI

InChI=1S/C31H33N3O5/c1-4-6-19-34-28(21-11-8-7-9-12-21)26(30(36)39-5-2)27(33-31(34)37)23-13-10-14-24(20-23)32-29(35)22-15-17-25(38-3)18-16-22/h7-18,20,27H,4-6,19H2,1-3H3,(H,32,35)(H,33,37)/t27-/m1/s1

InChI Key

PHBWNZZXFQREQY-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD14240953

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

527.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.223

Distribution Coefficient, logD

6.223

Water Solubility, LogSw

-5.44

Polar Surface Area

79.414

Acid Dissociation Constant (pKa)

10.80

Base Dissociation Constant (pKb)

-1.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.80

References: we are preparing a list of scientific research reports with V010-8393 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-8393?
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What is the minimum amount of V010-8393 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-8393
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-8393
  • 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 V010-8393 available by request