Y010-1200 Screening compound: 7-CHLORO-3-[4-(PYRIDIN-2-YL)PIPERAZINE-1-CARBONYL]-[1,2,3]TRIAZOLO[1,5-A]QUINAZOLIN-5-OL
Chemical Structure Depiction of ChemDiv screening compound Y010-1200
7-CHLORO-3-[4-(PYRIDIN-2-YL)PIPERAZINE-1-CARBONYL]-[1,2,3]TRIAZOLO[1,5-A]QUINAZOLIN-5-OL
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
Y010-1200
Molecular Formula
C19H16ClN7O2 (C19 H16 ClN7 O2)
Compound Name
7-CHLORO-3-[4-(PYRIDIN-2-YL)PIPERAZINE-1-CARBONYL]-[1,2,3]TRIAZOLO[1,5-A]QUINAZOLIN-5-OL
IUPAC name
7-chloro-3-[4-(pyridin-2-yl)piperazine-1-carbonyl]-[123]triazolo[15-a]quinazolin-5-ol
SMILES
Oc1nc2c(C(N(CC3)CCN3c3ncccc3)=O)nnn2c(cc2)c1cc2Cl
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
409.83
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
2.413
Distribution Coefficient, logD
0.165
Water Solubility, LogSw
-2.74
Polar Surface Area
77.847
Acid Dissociation Constant (pKa)
5.15
Base Dissociation Constant (pKb)
5.71
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
21.10
Y010-1200 in Drug Discovery
Included in Screening Libraries
Anti-Inflammatory Library (24602 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Immune system
- Agro
References: we are preparing a list of scientific research reports with Y010-1200 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)