L447-0277 Screening compound: 3-{2-[5-(diethylsulfamoyl)-1H-1,2,3-benzotriazol-1-yl]ethyl}-1-(3-fluorophenyl)urea

L447-0277 Screening compound: 3-{2-[5-(diethylsulfamoyl)-1H-1,2,3-benzotriazol-1-yl]ethyl}-1-(3-fluorophenyl)urea
L447-0277 Screening compound: 3-{2-[5-(diethylsulfamoyl)-1H-1,2,3-benzotriazol-1-yl]ethyl}-1-(3-fluorophenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound L447-0277
3-{2-[5-(diethylsulfamoyl)-1H-1,2,3-benzotriazol-1-yl]ethyl}-1-(3-fluorophenyl)urea

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

L447-0277

Molecular Formula

C19H23FN6O3S (C19 H23 FN6 O3 S)

Compound Name

3-{2-[5-(diethylsulfamoyl)-1H-1,2,3-benzotriazol-1-yl]ethyl}-1-(3-fluorophenyl)urea

IUPAC name

3-{2-[5-(diethylsulfamoyl)-1H-123-benzotriazol-1-yl]ethyl}-1-(3-fluorophenyl)urea

SMILES

CCN(CC)S(c(cc1)cc2c1n(CCNC(Nc1cc(F)ccc1)=O)nn2)(=O)=O

InChI

InChI=1S/C19H23FN6O3S/c1-3-25(4-2)30(28,29)16-8-9-18-17(13-16)23-24-26(18)11-10-21-19(27)22-15-7-5-6-14(20)12-15/h5-9,12-13H,3-4,10-11H2,1-2H3,(H2,21,22,27)

InChI Key

DOXCKRRISMCOCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27253027

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.440

Distribution Coefficient, logD

2.440

Water Solubility, LogSw

-3.03

Polar Surface Area

90.477

Acid Dissociation Constant (pKa)

11.75

Base Dissociation Constant (pKb)

1.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

L447-0277 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L447-0277 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L447-0277?
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What is the minimum amount of L447-0277 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L447-0277
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L447-0277
  • 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 L447-0277 available by request