1127-1213 Screening compound: 4-amino-N~1~-(6-amino-4-methyl-1,3-benzothiazol-2-yl)benzamide

1127-1213 Screening compound: 4-amino-N~1~-(6-amino-4-methyl-1,3-benzothiazol-2-yl)benzamide
1127-1213 Screening compound: 4-amino-N~1~-(6-amino-4-methyl-1,3-benzothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1127-1213
4-amino-N~1~-(6-amino-4-methyl-1,3-benzothiazol-2-yl)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

1127-1213

Molecular Formula

C15H14N4OS (C15 H14 N4 OS)

Compound Name

4-amino-N~1~-(6-amino-4-methyl-1,3-benzothiazol-2-yl)benzamide

IUPAC name

4-amino-N-(6-amino-4-methyl-13-benzothiazol-2-yl)benzamide

SMILES

Cc1cc(N)cc2c1nc(NC(c(cc1)ccc1N)=O)s2

InChI

InChI=1S/C15H14N4OS/c1-8-6-11(17)7-12-13(8)18-15(21-12)19-14(20)9-2-4-10(16)5-3-9/h2-7H,16-17H2,1H3,(H,18,19,20)

InChI Key

AJLSUSIARKZBGH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00689585

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.444

Distribution Coefficient, logD

2.435

Water Solubility, LogSw

-2.94

Polar Surface Area

75.473

Acid Dissociation Constant (pKa)

9.05

Base Dissociation Constant (pKb)

3.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.67

1127-1213 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 1127-1213 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1127-1213?
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What is the minimum amount of 1127-1213 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1127-1213
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1127-1213
  • 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 1127-1213 available by request