L693-0272 Screening compound: 1-(2-{[(3-bromophenyl)carbamoyl]amino}ethyl)-N,N-dimethyl-1H-1,2,3-benzotriazole-5-carboxamide

L693-0272 Screening compound: 1-(2-{[(3-bromophenyl)carbamoyl]amino}ethyl)-N,N-dimethyl-1H-1,2,3-benzotriazole-5-carboxamide
L693-0272 Screening compound: 1-(2-{[(3-bromophenyl)carbamoyl]amino}ethyl)-N,N-dimethyl-1H-1,2,3-benzotriazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L693-0272
1-(2-{[(3-bromophenyl)carbamoyl]amino}ethyl)-N,N-dimethyl-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

L693-0272

Molecular Formula

C18H19BrN6O2 (C18 H19 BrN6 O2)

Compound Name

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

IUPAC name

1-(2-{[(3-bromophenyl)carbamoyl]amino}ethyl)-NN-dimethyl-1H-123-benzotriazole-5-carboxamide

SMILES

CN(C)C(c(cc1)cc2c1n(CCNC(Nc1cccc(Br)c1)=O)nn2)=O

InChI

InChI=1S/C18H19BrN6O2/c1-24(2)17(26)12-6-7-16-15(10-12)22-23-25(16)9-8-20-18(27)21-14-5-3-4-13(19)11-14/h3-7,10-11H,8-9H2,1-2H3,(H2,20,21,27)

InChI Key

KKRCKSASHZWKQN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27470113

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.652

Distribution Coefficient, logD

1.652

Water Solubility, LogSw

-2.30

Polar Surface Area

75.382

Acid Dissociation Constant (pKa)

11.75

Base Dissociation Constant (pKb)

1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

L693-0272 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with L693-0272 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L693-0272?
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What is the minimum amount of L693-0272 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L693-0272
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L693-0272
  • 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 L693-0272 available by request