V010-5833 Screening compound: 3-[4-(4-cyanobenzoyl)piperazin-1-yl]-4-methoxy-N-(4-methoxyphenyl)-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound V010-5833
3-[4-(4-cyanobenzoyl)piperazin-1-yl]-4-methoxy-N-(4-methoxyphenyl)-N-methylbenzene-1-sulfonamide
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
V010-5833
Molecular Formula
C27H28N4O5S (C27 H28 N4 O5 S)
Compound Name
3-[4-(4-cyanobenzoyl)piperazin-1-yl]-4-methoxy-N-(4-methoxyphenyl)-N-methylbenzene-1-sulfonamide
IUPAC name
3-[4-(4-cyanobenzoyl)piperazin-1-yl]-4-methoxy-N-(4-methoxyphenyl)-N-methylbenzene-1-sulfonamide
SMILES
CN(c(cc1)ccc1OC)S(c(cc1)cc(N(CC2)CCN2C(c(cc2)ccc2C#N)=O)c1OC)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
520.61
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
3.824
Distribution Coefficient, logD
3.824
Water Solubility, LogSw
-4.11
Polar Surface Area
84.898
Acid Dissociation Constant (pKa)
28.39
Base Dissociation Constant (pKb)
0.94
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
25.90
V010-5833 in Drug Discovery
Included in Screening Libraries
Allosteric Kinases Inhibitors Library (23117 compounds)
Anticancer Library (62698 compounds)
Antimitotic Tubulin Library (17355 compounds)
Included in 1.7M Stock Database
- Cancer
- Female
- Congenital
- Skin
- Cancer
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
References: we are preparing a list of scientific research reports with V010-5833 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)