F414-1099 Screening compound: N-(4-bromo-3-methylphenyl)-5-[(4-methoxyphenyl)amino]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound F414-1099
N-(4-bromo-3-methylphenyl)-5-[(4-methoxyphenyl)amino]-1H-1,2,3-triazole-4-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
F414-1099
Molecular Formula
C17H16BrN5O2 (C17 H16 BrN5 O2)
Compound Name
N-(4-bromo-3-methylphenyl)-5-[(4-methoxyphenyl)amino]-1H-1,2,3-triazole-4-carboxamide
IUPAC name
N-(4-bromo-3-methylphenyl)-5-[(4-methoxyphenyl)amino]-1H-123-triazole-4-carboxamide
SMILES
Cc(cc(cc1)NC(c2c(Nc(cc3)ccc3OC)[nH]nn2)=O)c1Br
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
402.25
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.861
Distribution Coefficient, logD
3.795
Water Solubility, LogSw
-4.19
Polar Surface Area
77.099
Acid Dissociation Constant (pKa)
8.19
Base Dissociation Constant (pKb)
-3.18
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
11.80
F414-1099 in Drug Discovery
Included in Screening Libraries
Angiogenesis library (14822 compounds)
Included in 1.7M Stock Database
- Cancer
References: we are preparing a list of scientific research reports with F414-1099 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)