V016-0183 Screening compound: N-[2-(dimethylamino)ethyl]-N-({4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl}methyl)-4-methylbenzamide

V016-0183 Screening compound: N-[2-(dimethylamino)ethyl]-N-({4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl}methyl)-4-methylbenzamide
V016-0183 Screening compound: N-[2-(dimethylamino)ethyl]-N-({4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl}methyl)-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-0183
N-[2-(dimethylamino)ethyl]-N-({4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl}methyl)-4-methylbenzamide

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

V016-0183

Molecular Formula

C24H31FN4O2S (C24 H31 FN4 O2 S)

Compound Name

N-[2-(dimethylamino)ethyl]-N-({4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl}methyl)-4-methylbenzamide

IUPAC name

N-[2-(dimethylamino)ethyl]-N-({4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl}methyl)-4-methylbenzamide

SMILES

Cc(cc1)ccc1C(N(CCN(C)C)CC(C1)OCCN1C(Nc(cc1)ccc1F)=S)=O

InChI

InChI=1S/C24H31FN4O2S/c1-18-4-6-19(7-5-18)23(30)28(13-12-27(2)3)16-22-17-29(14-15-31-22)24(32)26-21-10-8-20(25)9-11-21/h4-11,22H,12-17H2,1-3H3,(H,26,32)/t22-/m0/s1

InChI Key

QLEKKGIEVDDWFW-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19919401

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

458.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.236

Distribution Coefficient, logD

2.370

Water Solubility, LogSw

-3.39

Polar Surface Area

39.221

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

8.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

References: we are preparing a list of scientific research reports with V016-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-0183?
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What is the minimum amount of V016-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-0183
  • 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 V016-0183 available by request