8561-07751 Screening compound: N-{5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}-6-methoxy-4-methylquinazolin-2-amine

8561-07751 Screening compound: N-{5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}-6-methoxy-4-methylquinazolin-2-amine
8561-07751 Screening compound: N-{5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}-6-methoxy-4-methylquinazolin-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8561-07751
N-{5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}-6-methoxy-4-methylquinazolin-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

8561-07751

Molecular Formula

C23H28N6O3 (C23 H28 N6 O3)

Compound Name

N-{5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}-6-methoxy-4-methylquinazolin-2-amine

IUPAC name

N-{5-[2-(34-dimethoxyphenyl)ethyl]-1456-tetrahydro-135-triazin-2-yl}-6-methoxy-4-methylquinazolin-2-amine

SMILES

Cc(c1c2)nc(NC3=NCN(CCc(cc4)cc(OC)c4OC)CN3)nc1ccc2OC

InChI

InChI=1S/C23H28N6O3/c1-15-18-12-17(30-2)6-7-19(18)27-23(26-15)28-22-24-13-29(14-25-22)10-9-16-5-8-20(31-3)21(11-16)32-4/h5-8,11-12H,9-10,13-14H2,1-4H3,(H2,24,25,26,27,28)

InChI Key

VAWMUYGEAURFSR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07181395

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.473

Distribution Coefficient, logD

-1.555

Water Solubility, LogSw

-3.78

Polar Surface Area

75.825

Acid Dissociation Constant (pKa)

13.84

Base Dissociation Constant (pKb)

9.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

8561-07751 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with 8561-07751 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8561-07751?
Check Price and Availability of 8561-07751, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8561-07751 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8561-07751
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8561-07751
  • 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 8561-07751 available by request