V005-6466 Screening compound: 4-(4-{2-[4-(3-chlorobenzenesulfonyl)piperazin-1-yl]pyrimidin-4-yl}phenyl)morpholine
Chemical Structure Depiction of ChemDiv screening compound V005-6466
4-(4-{2-[4-(3-chlorobenzenesulfonyl)piperazin-1-yl]pyrimidin-4-yl}phenyl)morpholine
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
V005-6466
Molecular Formula
C24H26ClN5O3S (C24 H26 ClN5 O3 S)
Compound Name
4-(4-{2-[4-(3-chlorobenzenesulfonyl)piperazin-1-yl]pyrimidin-4-yl}phenyl)morpholine
IUPAC name
4-(4-{2-[4-(3-chlorobenzenesulfonyl)piperazin-1-yl]pyrimidin-4-yl}phenyl)morpholine
SMILES
O=S(c1cccc(Cl)c1)(N(CC1)CCN1c1nc(-c(cc2)ccc2N2CCOCC2)ccn1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
500.02
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
4.390
Distribution Coefficient, logD
4.390
Water Solubility, LogSw
-4.54
Polar Surface Area
64.229
Acid Dissociation Constant (pKa)
20.87
Base Dissociation Constant (pKb)
3.60
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
33.30
V005-6466 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
PI3K-Targeted Library (17255 compounds)
Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Cancer
- Digestive system
- Nervous system
- Female
- Metabolic
- Endocrine
- Kinases
- Phosphatases
- Receptor's ligands
References: we are preparing a list of scientific research reports with V005-6466 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)