3235-0346 Screening compound: N-[2-({1-[(2-BROMOPHENYL)CARBAMOYL]-2-METHYLPROPYL}CARBAMOYL)PHENYL]-4-METHOXYBENZAMIDE

3235-0346 Screening compound: N-[2-({1-[(2-BROMOPHENYL)CARBAMOYL]-2-METHYLPROPYL}CARBAMOYL)PHENYL]-4-METHOXYBENZAMIDE
3235-0346 Screening compound: N-[2-({1-[(2-BROMOPHENYL)CARBAMOYL]-2-METHYLPROPYL}CARBAMOYL)PHENYL]-4-METHOXYBENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 3235-0346
N-[2-({1-[(2-BROMOPHENYL)CARBAMOYL]-2-METHYLPROPYL}CARBAMOYL)PHENYL]-4-METHOXYBENZAMIDE

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

3235-0346

Molecular Formula

C26H26BrN3O4 (C26 H26 BrN3 O4)

Compound Name

N-[2-({1-[(2-BROMOPHENYL)CARBAMOYL]-2-METHYLPROPYL}CARBAMOYL)PHENYL]-4-METHOXYBENZAMIDE

IUPAC name

n/a

SMILES

CC(C)C(C(Nc(cccc1)c1Br)=O)NC(c(cccc1)c1NC(c(cc1)ccc1OC)=O)=O

InChI

InChI=1S/C26H26BrN3O4/c1-16(2)23(26(33)29-22-11-7-5-9-20(22)27)30-25(32)19-8-4-6-10-21(19)28-24(31)17-12-14-18(34-3)15-13-17/h4-16,23H,1-3H3,(H,28,31)(H,29,33)(H,30,32)/t23-/m0/s1

InChI Key

UFRZXQXGAFJQCB-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD02042804

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

524.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.806

Distribution Coefficient, logD

4.802

Water Solubility, LogSw

-4.44

Polar Surface Area

76.606

Acid Dissociation Constant (pKa)

9.40

Base Dissociation Constant (pKb)

-1.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.20

3235-0346 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 3235-0346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3235-0346?
Check Price and Availability of 3235-0346, 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 3235-0346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3235-0346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3235-0346
  • 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 3235-0346 available by request