P664-0270 Screening compound: 1-{3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl}-4-(thiophene-3-carbonyl)piperazine
Chemical Structure Depiction of ChemDiv screening compound P664-0270
1-{3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl}-4-(thiophene-3-carbonyl)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
P664-0270
Molecular Formula
C16H18N6OS (C16 H18 N6 OS)
Compound Name
1-{3,5-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl}-4-(thiophene-3-carbonyl)piperazine
IUPAC name
1-{35-dimethyl-[124]triazolo[43-a]pyrimidin-7-yl}-4-(thiophene-3-carbonyl)piperazine
SMILES
Cc(n1c(C)c2)nnc1nc2N(CC1)CCN1C(c1cscc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
342.42
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.318
Distribution Coefficient, logD
1.317
Water Solubility, LogSw
-2.11
Polar Surface Area
52.704
Acid Dissociation Constant (pKa)
23.26
Base Dissociation Constant (pKb)
4.78
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
37.50
P664-0270 in Drug Discovery
Included in Screening Libraries
GPCR Targeted Library (31838 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- GPCR
- Proteases
- Receptor's ligands
References: we are preparing a list of scientific research reports with P664-0270 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)