L810-0039 Screening compound: 4-(3-chlorophenyl)-2-(1-pyrrolidinylcarbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione

L810-0039 Screening compound: 4-(3-chlorophenyl)-2-(1-pyrrolidinylcarbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
L810-0039 Screening compound: 4-(3-chlorophenyl)-2-(1-pyrrolidinylcarbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound L810-0039
4-(3-chlorophenyl)-2-(1-pyrrolidinylcarbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione

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

L810-0039

Molecular Formula

C19H17ClN2O3S (C19 H17 ClN2 O3 S)

Compound Name

4-(3-chlorophenyl)-2-(1-pyrrolidinylcarbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione

IUPAC name

4-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)-4H-1lambda64-benzothiazine-11-dione

SMILES

O=C(C1=CN(c2cccc(Cl)c2)c(cccc2)c2S1(=O)=O)N1CCCC1

InChI

InChI=1S/C19H17ClN2O3S/c20-14-6-5-7-15(12-14)22-13-18(19(23)21-10-3-4-11-21)26(24,25)17-9-2-1-8-16(17)22/h1-2,5-9,12-13H,3-4,10-11H2

InChI Key

NHRQOJDSMAKVHH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18788910

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.786

Distribution Coefficient, logD

2.786

Water Solubility, LogSw

-3.36

Polar Surface Area

47.965

Acid Dissociation Constant (pKa)

27.85

Base Dissociation Constant (pKb)

-2.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

L810-0039 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Nucleic Acid Ligands (8311 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with L810-0039 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L810-0039?
Check Price and Availability of L810-0039, 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 L810-0039 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L810-0039
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L810-0039
  • 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 L810-0039 available by request