L693-0319 Screening compound: N,N-dimethyl-1-(2-{[(2-methylpropyl)carbamoyl]amino}ethyl)-1H-1,2,3-benzotriazole-5-carboxamide

L693-0319 Screening compound: N,N-dimethyl-1-(2-{[(2-methylpropyl)carbamoyl]amino}ethyl)-1H-1,2,3-benzotriazole-5-carboxamide
L693-0319 Screening compound: N,N-dimethyl-1-(2-{[(2-methylpropyl)carbamoyl]amino}ethyl)-1H-1,2,3-benzotriazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L693-0319
N,N-dimethyl-1-(2-{[(2-methylpropyl)carbamoyl]amino}ethyl)-1H-1,2,3-benzotriazole-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

L693-0319

Molecular Formula

C16H24N6O2 (C16 H24 N6 O2)

Compound Name

N,N-dimethyl-1-(2-{[(2-methylpropyl)carbamoyl]amino}ethyl)-1H-1,2,3-benzotriazole-5-carboxamide

IUPAC name

NN-dimethyl-1-(2-{[(2-methylpropyl)carbamoyl]amino}ethyl)-1H-123-benzotriazole-5-carboxamide

SMILES

CC(C)CNC(NCCn1nnc2c1ccc(C(N(C)C)=O)c2)=O

InChI

InChI=1S/C16H24N6O2/c1-11(2)10-18-16(24)17-7-8-22-14-6-5-12(15(23)21(3)4)9-13(14)19-20-22/h5-6,9,11H,7-8,10H2,1-4H3,(H2,17,18,24)

InChI Key

MNHTXSXZQOAZSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27470142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.030

Distribution Coefficient, logD

-0.030

Water Solubility, LogSw

-1.91

Polar Surface Area

76.975

Acid Dissociation Constant (pKa)

15.81

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

L693-0319 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with L693-0319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L693-0319?
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What is the minimum amount of L693-0319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L693-0319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L693-0319
  • 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 L693-0319 available by request