7380-0028 Screening compound: 3-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide

7380-0028 Screening compound: 3-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide
7380-0028 Screening compound: 3-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7380-0028
3-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide

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

7380-0028

Molecular Formula

C17H17N3O3S (C17 H17 N3 O3 S)

Compound Name

3-(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide

IUPAC name

3-(2-oxo-23-dihydro-13-benzoxazol-3-yl)-N-(4567-tetrahydro-13-benzothiazol-2-yl)propanamide

SMILES

O=C(CCN(c(cccc1)c1O1)C1=O)Nc1nc(CCCC2)c2s1

InChI

InChI=1S/C17H17N3O3S/c21-15(19-16-18-11-5-1-4-8-14(11)24-16)9-10-20-12-6-2-3-7-13(12)23-17(20)22/h2-3,6-7H,1,4-5,8-10H2,(H,18,19,21)

InChI Key

PABQHBVLAKXDHA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06623601

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.300

Distribution Coefficient, logD

2.961

Water Solubility, LogSw

-3.75

Polar Surface Area

57.663

Acid Dissociation Constant (pKa)

7.33

Base Dissociation Constant (pKb)

4.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

References: we are preparing a list of scientific research reports with 7380-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7380-0028?
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What is the minimum amount of 7380-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7380-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7380-0028
  • 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 7380-0028 available by request