L693-0419 Screening compound: 1-(2-{[(4-chlorophenyl)carbamoyl]amino}ethyl)-N-(propan-2-yl)-1H-1,2,3-benzotriazole-5-carboxamide

L693-0419 Screening compound: 1-(2-{[(4-chlorophenyl)carbamoyl]amino}ethyl)-N-(propan-2-yl)-1H-1,2,3-benzotriazole-5-carboxamide
L693-0419 Screening compound: 1-(2-{[(4-chlorophenyl)carbamoyl]amino}ethyl)-N-(propan-2-yl)-1H-1,2,3-benzotriazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L693-0419
1-(2-{[(4-chlorophenyl)carbamoyl]amino}ethyl)-N-(propan-2-yl)-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

L693-0419

Molecular Formula

C19H21ClN6O2 (C19 H21 ClN6 O2)

Compound Name

1-(2-{[(4-chlorophenyl)carbamoyl]amino}ethyl)-N-(propan-2-yl)-1H-1,2,3-benzotriazole-5-carboxamide

IUPAC name

1-(2-{[(4-chlorophenyl)carbamoyl]amino}ethyl)-N-(propan-2-yl)-1H-123-benzotriazole-5-carboxamide

SMILES

CC(C)NC(c(cc1)cc2c1n(CCNC(Nc(cc1)ccc1Cl)=O)nn2)=O

InChI

InChI=1S/C19H21ClN6O2/c1-12(2)22-18(27)13-3-8-17-16(11-13)24-25-26(17)10-9-21-19(28)23-15-6-4-14(20)5-7-15/h3-8,11-12H,9-10H2,1-2H3,(H,22,27)(H2,21,23,28)

InChI Key

KVLWFEIHLHWHAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27470173

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.577

Distribution Coefficient, logD

2.577

Water Solubility, LogSw

-3.63

Polar Surface Area

83.040

Acid Dissociation Constant (pKa)

11.83

Base Dissociation Constant (pKb)

0.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with L693-0419 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L693-0419?
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What is the minimum amount of L693-0419 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L693-0419
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L693-0419
  • 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 L693-0419 available by request