8137-0552 Screening compound: N-[5-oxo-7-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinazolin-2-yl]-2-propylpentanamide

8137-0552 Screening compound: N-[5-oxo-7-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinazolin-2-yl]-2-propylpentanamide
8137-0552 Screening compound: N-[5-oxo-7-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinazolin-2-yl]-2-propylpentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8137-0552
N-[5-oxo-7-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinazolin-2-yl]-2-propylpentanamide

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

8137-0552

Molecular Formula

C25H33N3O5 (C25 H33 N3 O5)

Compound Name

N-[5-oxo-7-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinazolin-2-yl]-2-propylpentanamide

IUPAC name

N-[5-oxo-7-(345-trimethoxyphenyl)-5678-tetrahydroquinazolin-2-yl]-2-propylpentanamide

SMILES

CCCC(CCC)C(Nc(nc1)nc(CC(C2)c(cc3OC)cc(OC)c3OC)c1C2=O)=O

InChI

InChI=1S/C25H33N3O5/c1-6-8-15(9-7-2)24(30)28-25-26-14-18-19(27-25)10-16(11-20(18)29)17-12-21(31-3)23(33-5)22(13-17)32-4/h12-16H,6-11H2,1-5H3,(H,26,27,28,30)/t16-/m1/s1

InChI Key

LNDYNAWMSHHDBY-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD04179296

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.483

Distribution Coefficient, logD

4.103

Water Solubility, LogSw

-4.41

Polar Surface Area

81.204

Acid Dissociation Constant (pKa)

7.25

Base Dissociation Constant (pKb)

-1.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.00

References: we are preparing a list of scientific research reports with 8137-0552 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8137-0552?
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What is the minimum amount of 8137-0552 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8137-0552
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8137-0552
  • 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 8137-0552 available by request