8338-1105 Screening compound: 3,5-dichloro-4-methoxy-N-{2-methyl-5-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide

8338-1105 Screening compound: 3,5-dichloro-4-methoxy-N-{2-methyl-5-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide
8338-1105 Screening compound: 3,5-dichloro-4-methoxy-N-{2-methyl-5-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8338-1105
3,5-dichloro-4-methoxy-N-{2-methyl-5-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]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

8338-1105

Molecular Formula

C25H22Cl2N2O3 (C25 H22 Cl2 N2 O3)

Compound Name

3,5-dichloro-4-methoxy-N-{2-methyl-5-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide

IUPAC name

35-dichloro-4-methoxy-N-{2-methyl-5-[5-(propan-2-yl)-13-benzoxazol-2-yl]phenyl}benzamide

SMILES

CC(C)c(cc1)cc2c1oc(-c1cc(NC(c(cc3Cl)cc(Cl)c3OC)=O)c(C)cc1)n2

InChI

InChI=1S/C25H22Cl2N2O3/c1-13(2)15-7-8-22-21(11-15)29-25(32-22)16-6-5-14(3)20(12-16)28-24(30)17-9-18(26)23(31-4)19(27)10-17/h5-13H,1-4H3,(H,28,30)

InChI Key

GIIYPTHCDCBZIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03008954

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.150

Distribution Coefficient, logD

7.149

Water Solubility, LogSw

-6.55

Polar Surface Area

47.159

Acid Dissociation Constant (pKa)

10.14

Base Dissociation Constant (pKb)

-0.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 8338-1105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8338-1105?
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What is the minimum amount of 8338-1105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8338-1105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8338-1105
  • 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 8338-1105 available by request