V028-5783 Screening compound: N'-ethyl-N-({5-[isopropyl(methyl)amino]-3-phenyl-4-isoxazolyl}methyl)-N-(2-morpholinoethyl)thiourea

V028-5783 Screening compound: N'-ethyl-N-({5-[isopropyl(methyl)amino]-3-phenyl-4-isoxazolyl}methyl)-N-(2-morpholinoethyl)thiourea
V028-5783 Screening compound: N'-ethyl-N-({5-[isopropyl(methyl)amino]-3-phenyl-4-isoxazolyl}methyl)-N-(2-morpholinoethyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-5783
N'-ethyl-N-({5-[isopropyl(methyl)amino]-3-phenyl-4-isoxazolyl}methyl)-N-(2-morpholinoethyl)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

V028-5783

Molecular Formula

C23H35N5O2S (C23 H35 N5 O2 S)

Compound Name

N'-ethyl-N-({5-[isopropyl(methyl)amino]-3-phenyl-4-isoxazolyl}methyl)-N-(2-morpholinoethyl)thiourea

IUPAC name

3-ethyl-1-({5-[methyl(propan-2-yl)amino]-3-phenyl-12-oxazol-4-yl}methyl)-1-[2-(morpholin-4-yl)ethyl]thiourea

SMILES

CCNC(N(CCN1CCOCC1)Cc1c(N(C)C(C)C)onc1-c1ccccc1)=S

InChI

InChI=1S/C23H35N5O2S/c1-5-24-23(31)28(12-11-27-13-15-29-16-14-27)17-20-21(19-9-7-6-8-10-19)25-30-22(20)26(4)18(2)3/h6-10,18H,5,11-17H2,1-4H3,(H,24,31)

InChI Key

CTBBTCHNDVUBJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19878745

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

445.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.862

Distribution Coefficient, logD

2.121

Water Solubility, LogSw

-3.12

Polar Surface Area

49.139

Acid Dissociation Constant (pKa)

17.77

Base Dissociation Constant (pKb)

8.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.52

References: we are preparing a list of scientific research reports with V028-5783 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-5783?
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What is the minimum amount of V028-5783 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-5783
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-5783
  • 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 V028-5783 available by request