2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide

C17H12N4O3S — CID 166872710

IUPAC2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide
SMILESO=Nc1cnc(NC(=O)c2ccccc2NC(=O)c2ccccc2)s1
InChIInChI=1S/C17H12N4O3S/c22-15(11-6-2-1-3-7-11)19-13-9-5-4-8-12(13)16(23)20-17-18-10-14(21-24)25-17/h1-10H,(H,19,22)(H,18,20,23)
InChIKeyLREZXQVNQKCTDD-UHFFFAOYSA-N
MW352.38 g/mol
LogP4.05
Rot. Bonds5

About 2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide

2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide (PubChem CID 166872710) has the molecular formula C17H12N4O3S and a molecular weight of 352.38 g/mol. Its IUPAC name is 2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide
PubChem CID166872710
Molecular FormulaC17H12N4O3S
Molecular Weight352.38 g/mol
Exact Mass352.06
IUPAC Name2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide
SMILESO=Nc1cnc(NC(=O)c2ccccc2NC(=O)c2ccccc2)s1
InChIInChI=1S/C17H12N4O3S/c22-15(11-6-2-1-3-7-11)19-13-9-5-4-8-12(13)16(23)20-17-18-10-14(21-24)25-17/h1-10H,(H,19,22)(H,18,20,23)
InChIKeyLREZXQVNQKCTDD-UHFFFAOYSA-N
XLogP4.05
TPSA100.52 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.38
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-benzamido-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 35935216
2-fluoro-N-(5-nitroso-1,3-thiazol-2-yl)benzamide
CID 167361656
2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 2806491
2-benzamido-N-pyridin-4-ylbenzamide
CID 730926
2-benzamido-N-pyridin-3-ylbenzamide
CID 730923
[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl] 2-benzamidobenzoate
CID 3558595
N-(5-ethenyl-1,3-thiazol-2-yl)benzamide
CID 123927377
2-benzamido-N-(4-phenylphenyl)benzamide
CID 5224038
2-benzamidobenzamide
CID 702115
2-benzamido-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide
CID 35871469
2-benzamido-N-(4-methoxy-1,3-benzothiazol-2-yl)benzamide
CID 35871813
2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide
CID 4111465

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide (CID 166872710) is 2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide is O=Nc1cnc(NC(=O)c2ccccc2NC(=O)c2ccccc2)s1.
What is the InChIKey of 2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide?
The InChIKey is LREZXQVNQKCTDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4O3S/c22-15(11-6-2-1-3-7-11)19-13-9-5-4-8-12(13)16(23)20-17-18-10-14(21-24)25-17/h1-10H,(H,19,22)(H,18,20,23).
What are the key properties of 2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide?
2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide has a molecular weight of 352.38 g/mol, XLogP of 4.05, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 166872710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).