5-chloro-2-phenylpyrazolo[1,5-a]quinazoline

C16H10ClN3 — CID 73334175

IUPAC5-chloro-2-phenylpyrazolo[1,5-a]quinazoline
SMILESClc1nc2cc(-c3ccccc3)nn2c2ccccc12
InChIInChI=1S/C16H10ClN3/c17-16-12-8-4-5-9-14(12)20-15(18-16)10-13(19-20)11-6-2-1-3-7-11/h1-10H
InChIKeySGUPYSZXNBLHNN-UHFFFAOYSA-N
MW279.73 g/mol
LogP4.20
Rot. Bonds1

About 5-chloro-2-phenylpyrazolo[1,5-a]quinazoline

5-chloro-2-phenylpyrazolo[1,5-a]quinazoline (PubChem CID 73334175) has the molecular formula C16H10ClN3 and a molecular weight of 279.73 g/mol. Its IUPAC name is 5-chloro-2-phenylpyrazolo[1,5-a]quinazoline.

Molecular Properties

Compound Name5-chloro-2-phenylpyrazolo[1,5-a]quinazoline
PubChem CID73334175
Molecular FormulaC16H10ClN3
Molecular Weight279.73 g/mol
Exact Mass279.06
IUPAC Name5-chloro-2-phenylpyrazolo[1,5-a]quinazoline
SMILESClc1nc2cc(-c3ccccc3)nn2c2ccccc12
InChIInChI=1S/C16H10ClN3/c17-16-12-8-4-5-9-14(12)20-15(18-16)10-13(19-20)11-6-2-1-3-7-11/h1-10H
InChIKeySGUPYSZXNBLHNN-UHFFFAOYSA-N
XLogP4.20
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.73
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-phenylpyrazolo[1,5-a]quinazoline?
The IUPAC name of 5-chloro-2-phenylpyrazolo[1,5-a]quinazoline (CID 73334175) is 5-chloro-2-phenylpyrazolo[1,5-a]quinazoline.
What is the SMILES notation for 5-chloro-2-phenylpyrazolo[1,5-a]quinazoline?
The canonical SMILES for 5-chloro-2-phenylpyrazolo[1,5-a]quinazoline is Clc1nc2cc(-c3ccccc3)nn2c2ccccc12.
What is the InChIKey of 5-chloro-2-phenylpyrazolo[1,5-a]quinazoline?
The InChIKey is SGUPYSZXNBLHNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClN3/c17-16-12-8-4-5-9-14(12)20-15(18-16)10-13(19-20)11-6-2-1-3-7-11/h1-10H.
What are the key properties of 5-chloro-2-phenylpyrazolo[1,5-a]quinazoline?
5-chloro-2-phenylpyrazolo[1,5-a]quinazoline has a molecular weight of 279.73 g/mol, XLogP of 4.20, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-phenylpyrazolo[1,5-a]quinazoline is sourced from PubChem (CID 73334175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).