F409-0152 Screening compound: methyl 2-[2-({4-amino-5-[(5-chlorothiophen-2-yl)sulfonyl]pyrimidin-2-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of ChemDiv screening compound F409-0152
methyl 2-[2-({4-amino-5-[(5-chlorothiophen-2-yl)sulfonyl]pyrimidin-2-yl}sulfanyl)acetamido]benzoate
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
F409-0152
Molecular Formula
C18H15ClN4O5S3 (C18 H15 ClN4 O5 S3)
Compound Name
methyl 2-[2-({4-amino-5-[(5-chlorothiophen-2-yl)sulfonyl]pyrimidin-2-yl}sulfanyl)acetamido]benzoate
IUPAC name
methyl 2-[2-({4-amino-5-[(5-chlorothiophen-2-yl)sulfonyl]pyrimidin-2-yl}sulfanyl)acetamido]benzoate
SMILES
COC(c(cccc1)c1NC(CSc(nc1)nc(N)c1S(c(s1)ccc1Cl)(=O)=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
498.99
Hydrogen Bond Acceptors Count
12.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
2.756
Distribution Coefficient, logD
2.743
Water Solubility, LogSw
-3.69
Polar Surface Area
112.623
Acid Dissociation Constant (pKa)
8.92
Base Dissociation Constant (pKb)
-1.16
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
11.10
F409-0152 in Drug Discovery
Included in Screening Libraries
C-Met Library (15277 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Endocrine
- Kinases
- Receptor's ligands
References: we are preparing a list of scientific research reports with F409-0152 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)