10-chloronaphtho[2,1-g][1,3]benzoxazole

C15H8ClNO — CID 162517870

IUPAC10-chloronaphtho[2,1-g][1,3]benzoxazole
SMILESClc1ccc2ccc3ccc4ncoc4c3c2c1
InChIInChI=1S/C15H8ClNO/c16-11-5-3-9-1-2-10-4-6-13-15(18-8-17-13)14(10)12(9)7-11/h1-8H
InChIKeyTWLOFTIEUFGEIA-UHFFFAOYSA-N
MW253.69 g/mol
LogP4.79
Rot. Bonds

About 10-chloronaphtho[2,1-g][1,3]benzoxazole

10-chloronaphtho[2,1-g][1,3]benzoxazole (PubChem CID 162517870) has the molecular formula C15H8ClNO and a molecular weight of 253.69 g/mol. Its IUPAC name is 10-chloronaphtho[2,1-g][1,3]benzoxazole.

Molecular Properties

Compound Name10-chloronaphtho[2,1-g][1,3]benzoxazole
PubChem CID162517870
Molecular FormulaC15H8ClNO
Molecular Weight253.69 g/mol
Exact Mass253.03
IUPAC Name10-chloronaphtho[2,1-g][1,3]benzoxazole
SMILESClc1ccc2ccc3ccc4ncoc4c3c2c1
InChIInChI=1S/C15H8ClNO/c16-11-5-3-9-1-2-10-4-6-13-15(18-8-17-13)14(10)12(9)7-11/h1-8H
InChIKeyTWLOFTIEUFGEIA-UHFFFAOYSA-N
XLogP4.79
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.69
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 10-chloronaphtho[2,1-g][1,3]benzoxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-dichlorophenanthrene
CID 123462675
2,6-dichlorophenanthrene
CID 123290984
[1,3]oxazolo[5,4-a]acridine
CID 176655511
7-chloro-6-methyl-1,3-benzoxazole
CID 161041002
N-[4-[3-[4-(10-chloronaphtho[2,1-g][1,3]benzoxazol-2-yl)phenyl]phenyl]phenyl]-4-phenylaniline
CID 166965267
2,3,6-trichlorophenanthrene
CID 123278920
1-bromo-7-chloroisoquinoline
CID 70680391
1,3,8-trichlorophenazine
CID 154716543
furo[2,3-g][1,3]benzoxazole
CID 45120277
2,3,8-trichloroquinoxalino[2,3-b]quinoxaline
CID 101466553
2-bromo-7-chlorophenanthrene
CID 177099004
2-bromo-8-chlorophenazine
CID 119028483

Frequently Asked Questions

What is the IUPAC name of 10-chloronaphtho[2,1-g][1,3]benzoxazole?
The IUPAC name of 10-chloronaphtho[2,1-g][1,3]benzoxazole (CID 162517870) is 10-chloronaphtho[2,1-g][1,3]benzoxazole.
What is the SMILES notation for 10-chloronaphtho[2,1-g][1,3]benzoxazole?
The canonical SMILES for 10-chloronaphtho[2,1-g][1,3]benzoxazole is Clc1ccc2ccc3ccc4ncoc4c3c2c1.
What is the InChIKey of 10-chloronaphtho[2,1-g][1,3]benzoxazole?
The InChIKey is TWLOFTIEUFGEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8ClNO/c16-11-5-3-9-1-2-10-4-6-13-15(18-8-17-13)14(10)12(9)7-11/h1-8H.
What are the key properties of 10-chloronaphtho[2,1-g][1,3]benzoxazole?
10-chloronaphtho[2,1-g][1,3]benzoxazole has a molecular weight of 253.69 g/mol, XLogP of 4.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-chloronaphtho[2,1-g][1,3]benzoxazole is sourced from PubChem (CID 162517870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).