L276-0087 Screening compound: 2-({4-[(5-chlorothiophen-2-yl)sulfonyl]piperazin-1-yl}methyl)-1-ethyl-N,N-dimethyl-1H-1,3-benzodiazole-5-carboxamide

L276-0087 Screening compound: 2-({4-[(5-chlorothiophen-2-yl)sulfonyl]piperazin-1-yl}methyl)-1-ethyl-N,N-dimethyl-1H-1,3-benzodiazole-5-carboxamide
L276-0087 Screening compound: 2-({4-[(5-chlorothiophen-2-yl)sulfonyl]piperazin-1-yl}methyl)-1-ethyl-N,N-dimethyl-1H-1,3-benzodiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L276-0087
2-({4-[(5-chlorothiophen-2-yl)sulfonyl]piperazin-1-yl}methyl)-1-ethyl-N,N-dimethyl-1H-1,3-benzodiazole-5-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

L276-0087

Molecular Formula

C21H26ClN5O3S2 (C21 H26 ClN5 O3 S2)

Compound Name

2-({4-[(5-chlorothiophen-2-yl)sulfonyl]piperazin-1-yl}methyl)-1-ethyl-N,N-dimethyl-1H-1,3-benzodiazole-5-carboxamide

IUPAC name

2-({4-[(5-chlorothiophen-2-yl)sulfonyl]piperazin-1-yl}methyl)-1-ethyl-NN-dimethyl-1H-13-benzodiazole-5-carboxamide

SMILES

CCn1c(ccc(C(N(C)C)=O)c2)c2nc1CN(CC1)CCN1S(c(s1)ccc1Cl)(=O)=O

InChI

InChI=1S/C21H26ClN5O3S2/c1-4-27-17-6-5-15(21(28)24(2)3)13-16(17)23-19(27)14-25-9-11-26(12-10-25)32(29,30)20-8-7-18(22)31-20/h5-8,13H,4,9-12,14H2,1-3H3

InChI Key

JRDOKCSEIBTHPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15122453

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.05

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.968

Distribution Coefficient, logD

1.938

Water Solubility, LogSw

-2.94

Polar Surface Area

63.410

Acid Dissociation Constant (pKa)

24.13

Base Dissociation Constant (pKb)

6.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

L276-0087 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with L276-0087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L276-0087?
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What is the minimum amount of L276-0087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L276-0087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L276-0087
  • 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 L276-0087 available by request