N062-0010 Screening compound: 16-({[(2,4-dinitrophenyl)amino]carbonyl}hydrazono)stachan-18-oic acid
Chemical Structure Depiction of ChemDiv screening compound N062-0010
16-({[(2,4-dinitrophenyl)amino]carbonyl}hydrazono)stachan-18-oic acid
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
N062-0010
Molecular Formula
C27H35N5O7 (C27 H35 N5 O7)
Compound Name
16-({[(2,4-dinitrophenyl)amino]carbonyl}hydrazono)stachan-18-oic acid
IUPAC name
(1R4S5R9S13S14Z)-14-({[(24-dinitrophenyl)carbamoyl]amino}imino)-5913-trimethyltetracyclo[11.2.1.0^{110}.0^{49}]hexadecane-5-carboxylic acid
SMILES
C[C@](C[C@]1(C2)CC3)(CCC1[C@@](C)(CCC1)[C@@H]3[C@@]1(C)C(O)=O)C2=NNC(Nc(ccc([N+]([O-])=O)c1)c1[N+]([O-])=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
541.6
Hydrogen Bond Acceptors Count
14.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
12
Partition Coefficient, logP
4.695
Distribution Coefficient, logD
2.402
Water Solubility, LogSw
-4.59
Polar Surface Area
138.560
Acid Dissociation Constant (pKa)
5.11
Base Dissociation Constant (pKb)
0.40
Number of Chiral Centers
6.00
Percent sp3 carbon bonding
66.70
N062-0010 in Drug Discovery
Included in Screening Libraries
Regenerative Medicine Focused Library (23016 compounds)
Natural Compounds Library (353 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Phosphatases
References: we are preparing a list of scientific research reports with N062-0010 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)