C260-1155 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({2,4-dioxo-1-[(2,4,6-trimethylphenyl)methyl]-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)benzamide

C260-1155 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({2,4-dioxo-1-[(2,4,6-trimethylphenyl)methyl]-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)benzamide
C260-1155 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({2,4-dioxo-1-[(2,4,6-trimethylphenyl)methyl]-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C260-1155
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({2,4-dioxo-1-[(2,4,6-trimethylphenyl)methyl]-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)benzamide

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

C260-1155

Molecular Formula

C34H31N3O5 (C34 H31 N3 O5)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-({2,4-dioxo-1-[(2,4,6-trimethylphenyl)methyl]-1,2,3,4-tetrahydroquinazolin-3-yl}methyl)benzamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-4-({24-dioxo-1-[(246-trimethylphenyl)methyl]-1234-tetrahydroquinazolin-3-yl}methyl)benzamide

SMILES

Cc1cc(C)c(CN(c(cccc2)c2C(N2Cc(cc3)ccc3C(NCc(cc3)cc4c3OCO4)=O)=O)C2=O)c(C)c1

InChI

InChI=1S/C34H31N3O5/c1-21-14-22(2)28(23(3)15-21)19-36-29-7-5-4-6-27(29)33(39)37(34(36)40)18-24-8-11-26(12-9-24)32(38)35-17-25-10-13-30-31(16-25)42-20-41-30/h4-16H,17-20H2,1-3H3,(H,35,38)

InChI Key

VPYFDTKCKFIVDV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14737625

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

561.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.142

Distribution Coefficient, logD

6.142

Water Solubility, LogSw

-5.45

Polar Surface Area

72.796

Acid Dissociation Constant (pKa)

13.11

Base Dissociation Constant (pKb)

-3.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.60

C260-1155 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C260-1155 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C260-1155?
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What is the minimum amount of C260-1155 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C260-1155
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C260-1155
  • 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 C260-1155 available by request