P633-1457 Screening compound: 1-({1-butyl-1H-pyrrolo[2,3-b]pyridin-3-yl}sulfonyl)-4-(2-fluorophenyl)piperazine
Chemical Structure Depiction of ChemDiv screening compound P633-1457
1-({1-butyl-1H-pyrrolo[2,3-b]pyridin-3-yl}sulfonyl)-4-(2-fluorophenyl)piperazine
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
P633-1457
Molecular Formula
C21H25FN4O2S (C21 H25 FN4 O2 S)
Compound Name
1-({1-butyl-1H-pyrrolo[2,3-b]pyridin-3-yl}sulfonyl)-4-(2-fluorophenyl)piperazine
IUPAC name
1-({1-butyl-1H-pyrrolo[23-b]pyridin-3-yl}sulfonyl)-4-(2-fluorophenyl)piperazine
SMILES
CCCCn1c(nccc2)c2c(S(N(CC2)CCN2c(cccc2)c2F)(=O)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
416.52
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.499
Distribution Coefficient, logD
3.498
Water Solubility, LogSw
-3.69
Polar Surface Area
46.798
Acid Dissociation Constant (pKa)
25.16
Base Dissociation Constant (pKb)
4.12
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
38.10
P633-1457 in Drug Discovery
Included in Screening Libraries
Hsp90-Targeted Library (11355 compounds)
SmartTM Library (51161 compounds)
Epigenetics Focused Set (26518 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Immune system
References: we are preparing a list of scientific research reports with P633-1457 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)