F882-0173 Screening compound: methyl 4-[({2-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}carbamoyl)amino]benzoate

F882-0173 Screening compound: methyl 4-[({2-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}carbamoyl)amino]benzoate
F882-0173 Screening compound: methyl 4-[({2-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}carbamoyl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F882-0173
methyl 4-[({2-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}carbamoyl)amino]benzoate

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

F882-0173

Molecular Formula

C24H19ClN4O4S (C24 H19 ClN4 O4 S)

Compound Name

methyl 4-[({2-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}carbamoyl)amino]benzoate

IUPAC name

methyl 4-[({2-[({7-chloro-4-oxo-4H-pyrido[12-a]pyrimidin-2-yl}methyl)sulfanyl]phenyl}carbamoyl)amino]benzoate

SMILES

COC(c(cc1)ccc1NC(Nc(cccc1)c1SCC(N=C(C=C1)N2C=C1Cl)=CC2=O)=O)=O

InChI

InChI=1S/C24H19ClN4O4S/c1-33-23(31)15-6-9-17(10-7-15)27-24(32)28-19-4-2-3-5-20(19)34-14-18-12-22(30)29-13-16(25)8-11-21(29)26-18/h2-13H,14H2,1H3,(H2,27,28,32)

InChI Key

BSRLDUKDJAYZGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14970046

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.96

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.938

Distribution Coefficient, logD

3.938

Water Solubility, LogSw

-4.54

Polar Surface Area

79.251

Acid Dissociation Constant (pKa)

12.54

Base Dissociation Constant (pKb)

2.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

F882-0173 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 F882-0173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F882-0173?
Check Price and Availability of F882-0173, 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 F882-0173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F882-0173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F882-0173
  • 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 F882-0173 available by request