F172-0790 Screening compound: N-[5-(ethanesulfonyl)-2-({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methoxy)phenyl]-2-ethylbutanamide

F172-0790 Screening compound: N-[5-(ethanesulfonyl)-2-({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methoxy)phenyl]-2-ethylbutanamide
F172-0790 Screening compound: N-[5-(ethanesulfonyl)-2-({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methoxy)phenyl]-2-ethylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F172-0790
N-[5-(ethanesulfonyl)-2-({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methoxy)phenyl]-2-ethylbutanamide

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

F172-0790

Molecular Formula

C22H27N3O6S (C22 H27 N3 O6 S)

Compound Name

N-[5-(ethanesulfonyl)-2-({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methoxy)phenyl]-2-ethylbutanamide

IUPAC name

N-[5-(ethanesulfonyl)-2-({2-methyl-7-oxo-7H-[12]oxazolo[23-a]pyrimidin-5-yl}methoxy)phenyl]-2-ethylbutanamide

SMILES

CCC(CC)C(Nc(cc(cc1)S(CC)(=O)=O)c1OCC(N=C1N2OC(C)=C1)=CC2=O)=O

InChI

InChI=1S/C22H27N3O6S/c1-5-15(6-2)22(27)24-18-12-17(32(28,29)7-3)8-9-19(18)30-13-16-11-21(26)25-20(23-16)10-14(4)31-25/h8-12,15H,5-7,13H2,1-4H3,(H,24,27)

InChI Key

GXHVOCPDFBFBNC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27106674

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.698

Distribution Coefficient, logD

1.691

Water Solubility, LogSw

-2.67

Polar Surface Area

97.717

Acid Dissociation Constant (pKa)

9.14

Base Dissociation Constant (pKb)

3.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

References: we are preparing a list of scientific research reports with F172-0790 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F172-0790?
Check Price and Availability of F172-0790, 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 F172-0790 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F172-0790
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F172-0790
  • 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 F172-0790 available by request