P899-0333 Screening compound: N,N-dimethyl-5-[5-methyl-4-(morpholine-4-sulfonyl)furan-2-yl]-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound P899-0333
N,N-dimethyl-5-[5-methyl-4-(morpholine-4-sulfonyl)furan-2-yl]-1H-pyrazole-4-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
P899-0333
Molecular Formula
C15H20N4O5S (C15 H20 N4 O5 S)
Compound Name
N,N-dimethyl-5-[5-methyl-4-(morpholine-4-sulfonyl)furan-2-yl]-1H-pyrazole-4-carboxamide
IUPAC name
NN-dimethyl-5-[5-methyl-4-(morpholine-4-sulfonyl)furan-2-yl]-1H-pyrazole-4-carboxamide
SMILES
Cc(oc(-c([nH]nc1)c1C(N(C)C)=O)c1)c1S(N1CCOCC1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
368.41
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
-0.349
Distribution Coefficient, logD
-0.350
Water Solubility, LogSw
-2.06
Polar Surface Area
88.374
Acid Dissociation Constant (pKa)
6.52
Base Dissociation Constant (pKb)
4.00
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
46.70
P899-0333 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS MPO Library (28609 compounds)
SmartTM Library (51161 compounds)
Included in 1.7M Stock Database
- Nervous system
References: we are preparing a list of scientific research reports with P899-0333 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)