C679-6277 Screening compound: 2-methyl-N-[4-({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methoxy)phenyl]benzamide

C679-6277 Screening compound: 2-methyl-N-[4-({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methoxy)phenyl]benzamide
C679-6277 Screening compound: 2-methyl-N-[4-({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methoxy)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C679-6277
2-methyl-N-[4-({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methoxy)phenyl]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

C679-6277

Molecular Formula

C22H19N3O4 (C22 H19 N3 O4)

Compound Name

2-methyl-N-[4-({2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl}methoxy)phenyl]benzamide

IUPAC name

2-methyl-N-[4-({2-methyl-7-oxo-7H-[12]oxazolo[23-a]pyrimidin-5-yl}methoxy)phenyl]benzamide

SMILES

CC(ON12)=CC2=NC(COc(cc2)ccc2NC(c2c(C)cccc2)=O)=CC1=O

InChI

InChI=1S/C22H19N3O4/c1-14-5-3-4-6-19(14)22(27)24-16-7-9-18(10-8-16)28-13-17-12-21(26)25-20(23-17)11-15(2)29-25/h3-12H,13H2,1-2H3,(H,24,27)

InChI Key

BAONQZDGXMVHTP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26965526

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.581

Distribution Coefficient, logD

2.580

Water Solubility, LogSw

-3.32

Polar Surface Area

69.021

Acid Dissociation Constant (pKa)

10.35

Base Dissociation Constant (pKb)

3.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

C679-6277 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular

References: we are preparing a list of scientific research reports with C679-6277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C679-6277?
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What is the minimum amount of C679-6277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C679-6277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C679-6277
  • 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 C679-6277 available by request