F646-0577 Screening compound: 4-METHYL-N-[2-(5-METHYL-1H-INDOL-3-YL)ETHYL]-3-{3H-[1,2,3]TRIAZOLO[4,5-B]PYRIDIN-3-YL}BENZAMIDE
Chemical Structure Depiction of ChemDiv screening compound F646-0577
4-METHYL-N-[2-(5-METHYL-1H-INDOL-3-YL)ETHYL]-3-{3H-[1,2,3]TRIAZOLO[4,5-B]PYRIDIN-3-YL}BENZAMIDE
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
F646-0577
Molecular Formula
C24H22N6O (C24 H22 N6 O)
Compound Name
4-METHYL-N-[2-(5-METHYL-1H-INDOL-3-YL)ETHYL]-3-{3H-[1,2,3]TRIAZOLO[4,5-B]PYRIDIN-3-YL}BENZAMIDE
IUPAC name
4-methyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]-3-{3H-[123]triazolo[45-b]pyridin-3-yl}benzamide
SMILES
Cc(cc1)cc2c1[nH]cc2CCNC(c1cc(-n2nnc3cccnc23)c(C)cc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
410.48
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.458
Distribution Coefficient, logD
3.458
Water Solubility, LogSw
-3.65
Polar Surface Area
69.532
Acid Dissociation Constant (pKa)
12.95
Base Dissociation Constant (pKb)
1.11
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
16.70
F646-0577 in Drug Discovery
Included in Screening Libraries
Chelators targeting matrix metalloproteinases library (8930 compounds)
Targeted Diversity Library (40567 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Cardiovascular
- Proteases
- PPI modulators
- Mimetics
References: we are preparing a list of scientific research reports with F646-0577 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)