E966-1501 Screening compound: N-(2,3-dimethylphenyl)-1-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]piperidine-4-carboxamide

E966-1501 Screening compound: N-(2,3-dimethylphenyl)-1-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]piperidine-4-carboxamide
E966-1501 Screening compound: N-(2,3-dimethylphenyl)-1-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E966-1501
N-(2,3-dimethylphenyl)-1-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]piperidine-4-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

E966-1501

Molecular Formula

C23H27N3O4S2 (C23 H27 N3 O4 S2)

Compound Name

N-(2,3-dimethylphenyl)-1-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]piperidine-4-carboxamide

IUPAC name

N-(23-dimethylphenyl)-1-[(2-methyl-3-oxo-34-dihydro-2H-14-benzothiazin-6-yl)sulfonyl]piperidine-4-carboxamide

SMILES

CC1Sc(ccc(S(N(CC2)CCC2C(Nc2c(C)c(C)ccc2)=O)(=O)=O)c2)c2NC1=O

InChI

InChI=1S/C23H27N3O4S2/c1-14-5-4-6-19(15(14)2)24-23(28)17-9-11-26(12-10-17)32(29,30)18-7-8-21-20(13-18)25-22(27)16(3)31-21/h4-8,13,16-17H,9-12H2,1-3H3,(H,24,28)(H,25,27)/t16-/m1/s1

InChI Key

BNIBOCUFXKXQEN-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD14933874

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.62

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.809

Distribution Coefficient, logD

3.809

Water Solubility, LogSw

-3.78

Polar Surface Area

79.220

Acid Dissociation Constant (pKa)

11.79

Base Dissociation Constant (pKb)

0.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

E966-1501 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with E966-1501 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E966-1501?
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What is the minimum amount of E966-1501 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E966-1501
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E966-1501
  • 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 E966-1501 available by request