E475-0622 Screening compound: 1-[(2-fluorophenyl)methyl]-3-{8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carbonyl}-1,3-diazinane

E475-0622 Screening compound: 1-[(2-fluorophenyl)methyl]-3-{8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carbonyl}-1,3-diazinane
E475-0622 Screening compound: 1-[(2-fluorophenyl)methyl]-3-{8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carbonyl}-1,3-diazinane alternative view

Chemical Structure Depiction of ChemDiv screening compound E475-0622
1-[(2-fluorophenyl)methyl]-3-{8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carbonyl}-1,3-diazinane

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

E475-0622

Molecular Formula

C23H22FN3O3 (C23 H22 FN3 O3)

Compound Name

1-[(2-fluorophenyl)methyl]-3-{8-methyl-4H-chromeno[3,4-d][1,2]oxazole-3-carbonyl}-1,3-diazinane

IUPAC name

1-[(2-fluorophenyl)methyl]-3-{8-methyl-4H-chromeno[34-d][12]oxazole-3-carbonyl}-13-diazinane

SMILES

Cc(cc1)cc-2c1OCc1c2onc1C(N1CN(Cc(cccc2)c2F)CCC1)=O

InChI

InChI=1S/C23H22FN3O3/c1-15-7-8-20-17(11-15)22-18(13-29-20)21(25-30-22)23(28)27-10-4-9-26(14-27)12-16-5-2-3-6-19(16)24/h2-3,5-8,11H,4,9-10,12-14H2,1H3

InChI Key

PWKLEAQNQDKCMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14855627

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.087

Distribution Coefficient, logD

4.030

Water Solubility, LogSw

-4.24

Polar Surface Area

51.697

Acid Dissociation Constant (pKa)

19.32

Base Dissociation Constant (pKb)

6.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with E475-0622 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E475-0622?
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What is the minimum amount of E475-0622 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E475-0622
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E475-0622
  • 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 E475-0622 available by request