SA01-0811 Screening compound: 2-(dimethylamino)-4-[1-(ethanesulfonyl)pyrrolidin-3-yl]-N,N-dimethylpyrimidine-5-carboxamide
Chemical Structure Depiction of ChemDiv screening compound SA01-0811
2-(dimethylamino)-4-[1-(ethanesulfonyl)pyrrolidin-3-yl]-N,N-dimethylpyrimidine-5-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
SA01-0811
Molecular Formula
C15H25N5O3S (C15 H25 N5 O3 S)
Compound Name
2-(dimethylamino)-4-[1-(ethanesulfonyl)pyrrolidin-3-yl]-N,N-dimethylpyrimidine-5-carboxamide
IUPAC name
2-(dimethylamino)-4-[1-(ethanesulfonyl)pyrrolidin-3-yl]-NN-dimethylpyrimidine-5-carboxamide
SMILES
CCS(N(CC1)CC1c1nc(N(C)C)ncc1C(N(C)C)=O)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
355.46
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
0.123
Distribution Coefficient, logD
0.123
Water Solubility, LogSw
-1.68
Polar Surface Area
69.739
Acid Dissociation Constant (pKa)
22.12
Base Dissociation Constant (pKb)
3.26
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
66.67
SA01-0811 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
CNS MPO Library (28609 compounds)
PPI Helix Turn 3D-Mimetics Library (71298 compounds)
Protein-Protein Interaction Library (218420 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- Nervous system
- PPI modulators
- PPI modulators
- PPI modulators
- Mimetics
- Mimetics
References: we are preparing a list of scientific research reports with SA01-0811 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)