L653-0033 Screening compound: 2-PHENYL-N-({[(1,3-THIAZOL-4-YL)METHYL]CARBAMOYL}METHYL)BUTANAMIDE

L653-0033 Screening compound: 2-PHENYL-N-({[(1,3-THIAZOL-4-YL)METHYL]CARBAMOYL}METHYL)BUTANAMIDE
L653-0033 Screening compound: 2-PHENYL-N-({[(1,3-THIAZOL-4-YL)METHYL]CARBAMOYL}METHYL)BUTANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound L653-0033
2-PHENYL-N-({[(1,3-THIAZOL-4-YL)METHYL]CARBAMOYL}METHYL)BUTANAMIDE

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

L653-0033

Molecular Formula

C16H19N3O2S (C16 H19 N3 O2 S)

Compound Name

2-PHENYL-N-({[(1,3-THIAZOL-4-YL)METHYL]CARBAMOYL}METHYL)BUTANAMIDE

IUPAC name

n/a

SMILES

CCC(C(NCC(NCc1cscn1)=O)=O)c1ccccc1

InChI

InChI=1S/C16H19N3O2S/c1-2-14(12-6-4-3-5-7-12)16(21)18-9-15(20)17-8-13-10-22-11-19-13/h3-7,10-11,14H,2,8-9H2,1H3,(H,17,20)(H,18,21)/t14-/m1/s1

InChI Key

QQCNTYQCNUHWBD-CQSZACIVSA-N

MDL Number (MFCD)

MFCD15132683

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.442

Distribution Coefficient, logD

2.442

Water Solubility, LogSw

-2.68

Polar Surface Area

59.247

Acid Dissociation Constant (pKa)

12.92

Base Dissociation Constant (pKb)

2.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.30

L653-0033 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L653-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L653-0033?
Check Price and Availability of L653-0033, 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 L653-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L653-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L653-0033
  • 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 L653-0033 available by request