8017-5883 Screening compound: 4-amino-6-(dipropylamino)-1,3,5-triazine-2-carbonitrile

8017-5883 Screening compound: 4-amino-6-(dipropylamino)-1,3,5-triazine-2-carbonitrile
8017-5883 Screening compound: 4-amino-6-(dipropylamino)-1,3,5-triazine-2-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-5883
4-amino-6-(dipropylamino)-1,3,5-triazine-2-carbonitrile

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

8017-5883

Molecular Formula

C10H16N6 (C10 H16 N6)

Compound Name

4-amino-6-(dipropylamino)-1,3,5-triazine-2-carbonitrile

IUPAC name

4-amino-6-(dipropylamino)-135-triazine-2-carbonitrile

SMILES

CCCN(CCC)c1nc(N)nc(C#N)n1

InChI

InChI=1S/C10H16N6/c1-3-5-16(6-4-2)10-14-8(7-11)13-9(12)15-10/h3-6H2,1-2H3,(H2,12,13,14,15)

InChI Key

SIHSMDOMZJDPSN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06616741

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

220.28

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.296

Distribution Coefficient, logD

2.296

Water Solubility, LogSw

-2.19

Polar Surface Area

70.788

Acid Dissociation Constant (pKa)

15.61

Base Dissociation Constant (pKb)

8.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

8017-5883 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Akt-Targeted Library (14764 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8017-5883 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-5883?
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What is the minimum amount of 8017-5883 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-5883
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-5883
  • 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 8017-5883 available by request