N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide

C18H11FN2OS — CID 2309183

IUPACN-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide
SMILESO=C(Nc1nc2ccc3ccccc3c2s1)c1cccc(F)c1
InChIInChI=1S/C18H11FN2OS/c19-13-6-3-5-12(10-13)17(22)21-18-20-15-9-8-11-4-1-2-7-14(11)16(15)23-18/h1-10H,(H,20,21,22)
InChIKeyXLNNCZKYJXYOCF-UHFFFAOYSA-N
MW322.36 g/mol
LogP4.84
Rot. Bonds2

About N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide

N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide (PubChem CID 2309183) has the molecular formula C18H11FN2OS and a molecular weight of 322.36 g/mol. Its IUPAC name is N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide.

Molecular Properties

Compound NameN-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide
PubChem CID2309183
Molecular FormulaC18H11FN2OS
Molecular Weight322.36 g/mol
Exact Mass322.06
IUPAC NameN-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide
SMILESO=C(Nc1nc2ccc3ccccc3c2s1)c1cccc(F)c1
InChIInChI=1S/C18H11FN2OS/c19-13-6-3-5-12(10-13)17(22)21-18-20-15-9-8-11-4-1-2-7-14(11)16(15)23-18/h1-10H,(H,20,21,22)
InChIKeyXLNNCZKYJXYOCF-UHFFFAOYSA-N
XLogP4.84
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Benzamide, 4-amino-N-(benzothiazol-2-yl)-
CID 37560
N-2-Benzothiazolylbenzeneacetamide
CID 591403
N-Benzothiazol-2-yl-benzamide
CID 689669
Benzamide, N-2-benzothiazolyl-4-fluoro-
CID 749175
N-(1,3-Benzothiazol-2-YL)-4-tert-butylbenzamide
CID 722343
N-(1,3-Benzothiazol-2-yl)-3,3-diphenylpropanamide
CID 591698
N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide
CID 953496
N-(1,3-Benzothiazol-2-YL)-1-naphthamide
CID 708647
N-(1,3-Benzothiazol-2-YL)-2-fluorobenzamide
CID 717947
2-[(4-Aminobenzoyl)amino]-1,3-benzothiazole-6-carboxamide
CID 712274
2-fluoro-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide
CID 746903
N-(1,3-benzothiazol-2-yl)-4-phenylbenzamide
CID 790332

Frequently Asked Questions

What is the IUPAC name of N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide?
The IUPAC name of N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide (CID 2309183) is N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide.
What is the SMILES notation for N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide?
The canonical SMILES for N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide is O=C(Nc1nc2ccc3ccccc3c2s1)c1cccc(F)c1.
What is the InChIKey of N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide?
The InChIKey is XLNNCZKYJXYOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11FN2OS/c19-13-6-3-5-12(10-13)17(22)21-18-20-15-9-8-11-4-1-2-7-14(11)16(15)23-18/h1-10H,(H,20,21,22).
What are the key properties of N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide?
N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide has a molecular weight of 322.36 g/mol, XLogP of 4.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzo[g][1,3]benzothiazol-2-yl-3-fluorobenzamide is sourced from PubChem (CID 2309183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).