V015-6627 Screening compound: N-[4-(3-fluorobenzamido)cyclohexyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound V015-6627
N-[4-(3-fluorobenzamido)cyclohexyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3-thiazole-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
V015-6627
Molecular Formula
C28H32FN3O3S (C28 H32 FN3 O3 S)
Compound Name
N-[4-(3-fluorobenzamido)cyclohexyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-1,3-thiazole-4-carboxamide
IUPAC name
N-[4-(3-fluorobenzamido)cyclohexyl]-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-13-thiazole-4-carboxamide
SMILES
CC(C)c(ccc(C)c1)c1OCc1nc(C(NC(CC2)CCC2NC(c2cc(F)ccc2)=O)=O)cs1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
509.64
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
6.046
Distribution Coefficient, logD
6.046
Water Solubility, LogSw
-5.45
Polar Surface Area
66.139
Acid Dissociation Constant (pKa)
13.27
Base Dissociation Constant (pKb)
-0.40
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
39.30
V015-6627 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
MCL1 Targeted Library (12200 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Included in 1.7M Stock Database
- Cancer
- Eye
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- GPCR
- Ion Channels
- Receptor's ligands
- Epigenetic
References: we are preparing a list of scientific research reports with V015-6627 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)