G330-0013 Screening compound: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-[(morpholin-4-yl)methyl]-1,2-oxazole-3-carboxamide

G330-0013 Screening compound: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-[(morpholin-4-yl)methyl]-1,2-oxazole-3-carboxamide
G330-0013 Screening compound: N-(6-methoxy-1,3-benzothiazol-2-yl)-5-[(morpholin-4-yl)methyl]-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G330-0013
N-(6-methoxy-1,3-benzothiazol-2-yl)-5-[(morpholin-4-yl)methyl]-1,2-oxazole-3-carboxamide

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

G330-0013

Molecular Formula

C17H18N4O4S (C17 H18 N4 O4 S)

Compound Name

N-(6-methoxy-1,3-benzothiazol-2-yl)-5-[(morpholin-4-yl)methyl]-1,2-oxazole-3-carboxamide

IUPAC name

N-(6-methoxy-13-benzothiazol-2-yl)-5-[(morpholin-4-yl)methyl]-12-oxazole-3-carboxamide

SMILES

COc(cc1)cc2c1nc(NC(c1noc(CN3CCOCC3)c1)=O)s2

InChI

InChI=1S/C17H18N4O4S/c1-23-11-2-3-13-15(9-11)26-17(18-13)19-16(22)14-8-12(25-20-14)10-21-4-6-24-7-5-21/h2-3,8-9H,4-7,10H2,1H3,(H,18,19,22)

InChI Key

UJKWIXOVZOQEDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14997835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.640

Distribution Coefficient, logD

2.631

Water Solubility, LogSw

-3.16

Polar Surface Area

73.253

Acid Dissociation Constant (pKa)

10.92

Base Dissociation Constant (pKb)

5.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

G330-0013 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

PI3K-Targeted Library (17255 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with G330-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G330-0013?
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What is the minimum amount of G330-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G330-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G330-0013
  • 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 G330-0013 available by request