F652-0110 Screening compound: methyl 2-[(3-methyl-1H-indazole-1-carbonyl)amino]benzoate
Chemical Structure Depiction of ChemDiv screening compound F652-0110
methyl 2-[(3-methyl-1H-indazole-1-carbonyl)amino]benzoate
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
F652-0110
Molecular Formula
C17H15N3O3 (C17 H15 N3 O3)
Compound Name
methyl 2-[(3-methyl-1H-indazole-1-carbonyl)amino]benzoate
IUPAC name
methyl 2-[(3-methyl-1H-indazole-1-carbonyl)amino]benzoate
SMILES
Cc1nn(C(Nc(cccc2)c2C(OC)=O)=O)c2c1cccc2
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
309.32
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.045
Distribution Coefficient, logD
3.042
Water Solubility, LogSw
-3.45
Polar Surface Area
56.652
Acid Dissociation Constant (pKa)
9.61
Base Dissociation Constant (pKb)
-4.04
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
11.80
F652-0110 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
Antifungal Library (16415 compounds)
Immunological Library (6760 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Infections
- Immune system
- animal
- Immune system
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- Epigenetic
- Agro
- Proteases
- Others
References: we are preparing a list of scientific research reports with F652-0110 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)