8563-1072 Screening compound: N-[5-(3-methoxypropyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl]-4,6-dimethylquinazolin-2-amine

8563-1072 Screening compound: N-[5-(3-methoxypropyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl]-4,6-dimethylquinazolin-2-amine
8563-1072 Screening compound: N-[5-(3-methoxypropyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl]-4,6-dimethylquinazolin-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8563-1072
N-[5-(3-methoxypropyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl]-4,6-dimethylquinazolin-2-amine

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

8563-1072

Molecular Formula

C17H24N6O (C17 H24 N6 O)

Compound Name

N-[5-(3-methoxypropyl)-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl]-4,6-dimethylquinazolin-2-amine

IUPAC name

N-[5-(3-methoxypropyl)-1456-tetrahydro-135-triazin-2-yl]-46-dimethylquinazolin-2-amine

SMILES

Cc1ccc2nc(NC3=NCN(CCCOC)CN3)nc(C)c2c1

InChI

InChI=1S/C17H24N6O/c1-12-5-6-15-14(9-12)13(2)20-17(21-15)22-16-18-10-23(11-19-16)7-4-8-24-3/h5-6,9H,4,7-8,10-11H2,1-3H3,(H2,18,19,20,21,22)

InChI Key

LADIZULPHNNTBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08088857

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.891

Distribution Coefficient, logD

-2.251

Water Solubility, LogSw

-3.13

Polar Surface Area

61.634

Acid Dissociation Constant (pKa)

13.84

Base Dissociation Constant (pKb)

9.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.10

8563-1072 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8563-1072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8563-1072?
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What is the minimum amount of 8563-1072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8563-1072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8563-1072
  • 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 8563-1072 available by request