C467-0132 Screening compound: 1-(3-methylphenyl)-3-[2-(morpholin-4-yl)-2-(pyridin-3-yl)ethyl]thiourea

C467-0132 Screening compound: 1-(3-methylphenyl)-3-[2-(morpholin-4-yl)-2-(pyridin-3-yl)ethyl]thiourea
C467-0132 Screening compound: 1-(3-methylphenyl)-3-[2-(morpholin-4-yl)-2-(pyridin-3-yl)ethyl]thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C467-0132
1-(3-methylphenyl)-3-[2-(morpholin-4-yl)-2-(pyridin-3-yl)ethyl]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

C467-0132

Molecular Formula

C19H24N4OS (C19 H24 N4 OS)

Compound Name

1-(3-methylphenyl)-3-[2-(morpholin-4-yl)-2-(pyridin-3-yl)ethyl]thiourea

IUPAC name

1-(3-methylphenyl)-3-[2-(morpholin-4-yl)-2-(pyridin-3-yl)ethyl]thiourea

SMILES

Cc1cccc(NC(NCC(c2cnccc2)N2CCOCC2)=S)c1

InChI

InChI=1S/C19H24N4OS/c1-15-4-2-6-17(12-15)22-19(25)21-14-18(16-5-3-7-20-13-16)23-8-10-24-11-9-23/h2-7,12-13,18H,8-11,14H2,1H3,(H2,21,22,25)/t18-/m0/s1

InChI Key

JBXTZBCXRCHXSE-SFHVURJKSA-N

MDL Number (MFCD)

MFCD04467288

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.149

Distribution Coefficient, logD

2.105

Water Solubility, LogSw

-2.06

Polar Surface Area

40.799

Acid Dissociation Constant (pKa)

14.57

Base Dissociation Constant (pKb)

6.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

C467-0132 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with C467-0132 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C467-0132?
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What is the minimum amount of C467-0132 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C467-0132
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C467-0132
  • 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 C467-0132 available by request