3229-1705 Screening compound: 1-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-3-(prop-2-en-1-yl)thiourea

3229-1705 Screening compound: 1-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-3-(prop-2-en-1-yl)thiourea
3229-1705 Screening compound: 1-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-3-(prop-2-en-1-yl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3229-1705
1-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-3-(prop-2-en-1-yl)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

3229-1705

Molecular Formula

C15H24N8O2S (C15 H24 N8 O2 S)

Compound Name

1-{[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-3-(prop-2-en-1-yl)thiourea

IUPAC name

1-{[46-bis(morpholin-4-yl)-135-triazin-2-yl]amino}-3-(prop-2-en-1-yl)thiourea

SMILES

C=CCNC(NNc1nc(N2CCOCC2)nc(N2CCOCC2)n1)=S

InChI

InChI=1S/C15H24N8O2S/c1-2-3-16-15(26)21-20-12-17-13(22-4-8-24-9-5-22)19-14(18-12)23-6-10-25-11-7-23/h2H,1,3-11H2,(H2,16,21,26)(H,17,18,19,20)

InChI Key

OKUIGRQBEPJUEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01361293

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.716

Distribution Coefficient, logD

1.422

Water Solubility, LogSw

-2.26

Polar Surface Area

85.999

Acid Dissociation Constant (pKa)

9.96

Base Dissociation Constant (pKb)

6.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

3229-1705 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3229-1705 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3229-1705?
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What is the minimum amount of 3229-1705 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3229-1705
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3229-1705
  • 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 3229-1705 available by request