F067-1222 Screening compound: 2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-[(4-methylphenyl)methyl]-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide

F067-1222 Screening compound: 2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-[(4-methylphenyl)methyl]-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide
F067-1222 Screening compound: 2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-[(4-methylphenyl)methyl]-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F067-1222
2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-[(4-methylphenyl)methyl]-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide

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

F067-1222

Molecular Formula

C30H31N3O3S (C30 H31 N3 O3 S)

Compound Name

2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-[(4-methylphenyl)methyl]-4-oxo-N-propyl-3,4-dihydroquinazoline-7-carboxamide

IUPAC name

2-{[2-(24-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-[(4-methylphenyl)methyl]-4-oxo-N-propyl-34-dihydroquinazoline-7-carboxamide

SMILES

CCCNC(c(cc1)cc(N=C(N2Cc3ccc(C)cc3)SCC(c3c(C)cc(C)cc3)=O)c1C2=O)=O

InChI

InChI=1S/C30H31N3O3S/c1-5-14-31-28(35)23-11-13-25-26(16-23)32-30(33(29(25)36)17-22-9-6-19(2)7-10-22)37-18-27(34)24-12-8-20(3)15-21(24)4/h6-13,15-16H,5,14,17-18H2,1-4H3,(H,31,35)

InChI Key

MGWXBHRXJPBJIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14939442

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

513.66

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.879

Distribution Coefficient, logD

5.879

Water Solubility, LogSw

-5.36

Polar Surface Area

63.544

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

0.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

References: we are preparing a list of scientific research reports with F067-1222 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F067-1222?
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What is the minimum amount of F067-1222 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F067-1222
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F067-1222
  • 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 F067-1222 available by request