L693-0307 Screening compound: 1-[2-({[(FURAN-2-YL)METHYL]CARBAMOYL}AMINO)ETHYL]-N,N-DIMETHYL-1H-1,2,3-BENZOTRIAZOLE-5-CARBOXAMIDE

L693-0307 Screening compound: 1-[2-({[(FURAN-2-YL)METHYL]CARBAMOYL}AMINO)ETHYL]-N,N-DIMETHYL-1H-1,2,3-BENZOTRIAZOLE-5-CARBOXAMIDE
L693-0307 Screening compound: 1-[2-({[(FURAN-2-YL)METHYL]CARBAMOYL}AMINO)ETHYL]-N,N-DIMETHYL-1H-1,2,3-BENZOTRIAZOLE-5-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound L693-0307
1-[2-({[(FURAN-2-YL)METHYL]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

L693-0307

Molecular Formula

C17H20N6O3 (C17 H20 N6 O3)

Compound Name

1-[2-({[(FURAN-2-YL)METHYL]CARBAMOYL}AMINO)ETHYL]-N,N-DIMETHYL-1H-1,2,3-BENZOTRIAZOLE-5-CARBOXAMIDE

IUPAC name

n/a

SMILES

CN(C)C(c(cc1)cc2c1n(CCNC(NCc1ccco1)=O)nn2)=O

InChI

InChI=1S/C17H20N6O3/c1-22(2)16(24)12-5-6-15-14(10-12)20-21-23(15)8-7-18-17(25)19-11-13-4-3-9-26-13/h3-6,9-10H,7-8,11H2,1-2H3,(H2,18,19,25)

InChI Key

SKCGQKVRTZHSIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27470134

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.157

Distribution Coefficient, logD

-0.157

Water Solubility, LogSw

-1.70

Polar Surface Area

84.452

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

L693-0307 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L693-0307 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L693-0307?
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What is the minimum amount of L693-0307 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L693-0307
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L693-0307
  • 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 L693-0307 available by request