SC69-0666 Screening compound: N~2~-(2-chloro-4-methylphenyl)-4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonane-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound SC69-0666
N~2~-(2-chloro-4-methylphenyl)-4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonane-2-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
SC69-0666
Molecular Formula
C20H26ClN5O (C20 H26 ClN5 O)
Compound Name
N~2~-(2-chloro-4-methylphenyl)-4-(4-ethyl-4H-1,2,4-triazol-3-yl)-2-azaspiro[4.4]nonane-2-carboxamide
IUPAC name
N-(2-chloro-4-methylphenyl)-4-(4-ethyl-4H-124-triazol-3-yl)-2-azaspiro[4.4]nonane-2-carboxamide
SMILES
CCn1c(C(C2)C3(CCCC3)CN2C(Nc(ccc(C)c2)c2Cl)=O)nnc1
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
387.91
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.236
Distribution Coefficient, logD
3.236
Water Solubility, LogSw
-3.47
Polar Surface Area
49.610
Acid Dissociation Constant (pKa)
11.93
Base Dissociation Constant (pKb)
6.17
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
55.00
References: we are preparing a list of scientific research reports with SC69-0666 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)