C548-2070 Screening compound: N-(6-ETHOXY-1,3-BENZOTHIAZOL-2-YL)-1-(1H-IMIDAZOLE-4-SULFONYL)PIPERIDINE-3-CARBOXAMIDE

C548-2070 Screening compound: N-(6-ETHOXY-1,3-BENZOTHIAZOL-2-YL)-1-(1H-IMIDAZOLE-4-SULFONYL)PIPERIDINE-3-CARBOXAMIDE
C548-2070 Screening compound: N-(6-ETHOXY-1,3-BENZOTHIAZOL-2-YL)-1-(1H-IMIDAZOLE-4-SULFONYL)PIPERIDINE-3-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C548-2070
N-(6-ETHOXY-1,3-BENZOTHIAZOL-2-YL)-1-(1H-IMIDAZOLE-4-SULFONYL)PIPERIDINE-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

C548-2070

Molecular Formula

C18H21N5O4S2 (C18 H21 N5 O4 S2)

Compound Name

N-(6-ETHOXY-1,3-BENZOTHIAZOL-2-YL)-1-(1H-IMIDAZOLE-4-SULFONYL)PIPERIDINE-3-CARBOXAMIDE

IUPAC name

n/a

SMILES

CCOc(cc1)cc2c1nc(NC(C(CCC1)CN1S(c1c[nH]cn1)(=O)=O)=O)s2

InChI

InChI=1S/C18H21N5O4S2/c1-2-27-13-5-6-14-15(8-13)28-18(21-14)22-17(24)12-4-3-7-23(10-12)29(25,26)16-9-19-11-20-16/h5-6,8-9,11-12H,2-4,7,10H2,1H3,(H,19,20)(H,21,22,24)/t12-/m0/s1

InChI Key

QCVMMKWYZFJPHP-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD14769366

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.315

Distribution Coefficient, logD

2.315

Water Solubility, LogSw

-3.03

Polar Surface Area

92.932

Acid Dissociation Constant (pKa)

10.37

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

9.00

C548-2070 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C548-2070 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C548-2070?
Check Price and Availability of C548-2070, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C548-2070 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C548-2070
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C548-2070
  • 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 C548-2070 available by request