V025-3572 Screening compound: N-(1-benzyl-2-{[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)-4-fluorobenzamide
Chemical Structure Depiction of ChemDiv screening compound V025-3572
N-(1-benzyl-2-{[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)-4-fluorobenzamide
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
V025-3572
Molecular Formula
C24H18BrFN4O2S (C24 H18 BrFN4 O2 S)
Compound Name
N-(1-benzyl-2-{[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)-4-fluorobenzamide
IUPAC name
N-[5-(4-bromophenyl)-134-thiadiazol-2-yl]-2-[(4-fluorophenyl)formamido]-3-phenylpropanamide
SMILES
O=C(C(Cc1ccccc1)NC(c(cc1)ccc1F)=O)Nc1nnc(-c(cc2)ccc2Br)s1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
525.4
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.694
Distribution Coefficient, logD
5.694
Water Solubility, LogSw
-5.94
Polar Surface Area
70.647
Acid Dissociation Constant (pKa)
10.29
Base Dissociation Constant (pKb)
-4.31
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
8.33
V025-3572 in Drug Discovery
Included in Screening Libraries
Protein Arginine Methyltransferases Library (27925 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Others
- Epigenetic
References: we are preparing a list of scientific research reports with V025-3572 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)