3332-1145 Screening compound: ethyl 2-[6-bromo-2-(4-methoxyphenyl)-4-phenyl-1,2,3,4-tetrahydroquinazolin-3-yl]acetate

3332-1145 Screening compound: ethyl 2-[6-bromo-2-(4-methoxyphenyl)-4-phenyl-1,2,3,4-tetrahydroquinazolin-3-yl]acetate
3332-1145 Screening compound: ethyl 2-[6-bromo-2-(4-methoxyphenyl)-4-phenyl-1,2,3,4-tetrahydroquinazolin-3-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3332-1145
ethyl 2-[6-bromo-2-(4-methoxyphenyl)-4-phenyl-1,2,3,4-tetrahydroquinazolin-3-yl]acetate

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

3332-1145

Molecular Formula

C25H25BrN2O3 (C25 H25 BrN2 O3)

Compound Name

ethyl 2-[6-bromo-2-(4-methoxyphenyl)-4-phenyl-1,2,3,4-tetrahydroquinazolin-3-yl]acetate

IUPAC name

ethyl 2-[6-bromo-2-(4-methoxyphenyl)-4-phenyl-1234-tetrahydroquinazolin-3-yl]acetate

SMILES

CCOC(CN(C1c2ccccc2)C(c(cc2)ccc2OC)Nc(cc2)c1cc2Br)=O

InChI

InChI=1S/C25H25BrN2O3/c1-3-31-23(29)16-28-24(17-7-5-4-6-8-17)21-15-19(26)11-14-22(21)27-25(28)18-9-12-20(30-2)13-10-18/h4-15,24-25,27H,3,16H2,1-2H3

InChI Key

ZOGZCKNWOUKEMZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01953965

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.186

Distribution Coefficient, logD

6.184

Water Solubility, LogSw

-5.47

Polar Surface Area

41.843

Acid Dissociation Constant (pKa)

18.28

Base Dissociation Constant (pKb)

4.96

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with 3332-1145 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3332-1145?
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What is the minimum amount of 3332-1145 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3332-1145
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3332-1145
  • 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 3332-1145 available by request