C301-6276 Screening compound: methyl 4-{[4-(4-bromophenyl)-1,3-thiazol-2-yl](propyl)carbamoyl}butanoate

C301-6276 Screening compound: methyl 4-{[4-(4-bromophenyl)-1,3-thiazol-2-yl](propyl)carbamoyl}butanoate
C301-6276 Screening compound: methyl 4-{[4-(4-bromophenyl)-1,3-thiazol-2-yl](propyl)carbamoyl}butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-6276
methyl 4-{[4-(4-bromophenyl)-1,3-thiazol-2-yl](propyl)carbamoyl}butanoate

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

C301-6276

Molecular Formula

C18H21BrN2O3S (C18 H21 BrN2 O3 S)

Compound Name

methyl 4-{[4-(4-bromophenyl)-1,3-thiazol-2-yl](propyl)carbamoyl}butanoate

IUPAC name

methyl 4-{[4-(4-bromophenyl)-13-thiazol-2-yl](propyl)carbamoyl}butanoate

SMILES

CCCN(C(CCCC(OC)=O)=O)c1nc(-c(cc2)ccc2Br)cs1

InChI

InChI=1S/C18H21BrN2O3S/c1-3-11-21(16(22)5-4-6-17(23)24-2)18-20-15(12-25-18)13-7-9-14(19)10-8-13/h7-10,12H,3-6,11H2,1-2H3

InChI Key

NFQGNBAGFLNRPO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14744362

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.269

Distribution Coefficient, logD

5.269

Water Solubility, LogSw

-5.06

Polar Surface Area

45.711

Acid Dissociation Constant (pKa)

22.30

Base Dissociation Constant (pKb)

-0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

C301-6276 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C301-6276 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-6276?
Check Price and Availability of C301-6276, 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 C301-6276 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-6276
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-6276
  • 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 C301-6276 available by request