V007-1576 Screening compound: 3-ethyl-1-(3-methylbutyl)-1-{[3-phenyl-5-(1,2,3,4-tetrahydroisoquinolin-2-yl)-1,2-oxazol-4-yl]methyl}thiourea

V007-1576 Screening compound: 3-ethyl-1-(3-methylbutyl)-1-{[3-phenyl-5-(1,2,3,4-tetrahydroisoquinolin-2-yl)-1,2-oxazol-4-yl]methyl}thiourea
V007-1576 Screening compound: 3-ethyl-1-(3-methylbutyl)-1-{[3-phenyl-5-(1,2,3,4-tetrahydroisoquinolin-2-yl)-1,2-oxazol-4-yl]methyl}thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-1576
3-ethyl-1-(3-methylbutyl)-1-{[3-phenyl-5-(1,2,3,4-tetrahydroisoquinolin-2-yl)-1,2-oxazol-4-yl]methyl}thiourea

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

V007-1576

Molecular Formula

C27H34N4OS (C27 H34 N4 OS)

Compound Name

3-ethyl-1-(3-methylbutyl)-1-{[3-phenyl-5-(1,2,3,4-tetrahydroisoquinolin-2-yl)-1,2-oxazol-4-yl]methyl}thiourea

IUPAC name

3-ethyl-1-(3-methylbutyl)-1-{[3-phenyl-5-(1234-tetrahydroisoquinolin-2-yl)-12-oxazol-4-yl]methyl}thiourea

SMILES

CCNC(N(CCC(C)C)Cc1c(N(CC2)Cc3c2cccc3)onc1-c1ccccc1)=S

InChI

InChI=1S/C27H34N4OS/c1-4-28-27(33)31(16-14-20(2)3)19-24-25(22-11-6-5-7-12-22)29-32-26(24)30-17-15-21-10-8-9-13-23(21)18-30/h5-13,20H,4,14-19H2,1-3H3,(H,28,33)

InChI Key

WHWISPMYHCFZBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19877029

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.66

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.088

Distribution Coefficient, logD

6.088

Water Solubility, LogSw

-5.62

Polar Surface Area

37.857

Acid Dissociation Constant (pKa)

17.77

Base Dissociation Constant (pKb)

0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

References: we are preparing a list of scientific research reports with V007-1576 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-1576?
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What is the minimum amount of V007-1576 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-1576
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-1576
  • 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 V007-1576 available by request