4111-3797 Screening compound: N,N'-bis[4-(morpholine-4-sulfonyl)phenyl]pentanediamide
Chemical Structure Depiction of ChemDiv screening compound 4111-3797
N,N'-bis[4-(morpholine-4-sulfonyl)phenyl]pentanediamide
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
4111-3797
Molecular Formula
C25H32N4O8S2 (C25 H32 N4 O8 S2)
Compound Name
N,N'-bis[4-(morpholine-4-sulfonyl)phenyl]pentanediamide
IUPAC name
NN'-bis[4-(morpholine-4-sulfonyl)phenyl]pentanediamide
SMILES
O=C(CCCC(Nc(cc1)ccc1S(N1CCOCC1)(=O)=O)=O)Nc(cc1)ccc1S(N1CCOCC1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
580.68
Hydrogen Bond Acceptors Count
16.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
12.00
Number of Nitrogen and Oxygen Atoms
12
Partition Coefficient, logP
0.631
Distribution Coefficient, logD
0.630
Water Solubility, LogSw
-2.38
Polar Surface Area
125.505
Acid Dissociation Constant (pKa)
10.08
Base Dissociation Constant (pKb)
-1.62
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
44.00
4111-3797 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
Regenerative Medicine Focused Library (23016 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
- Others
- Epigenetic
References: we are preparing a list of scientific research reports with 4111-3797 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)