2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide

C16H12N4O2S — CID 2806491

IUPAC2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide
SMILESO=C(Nc1ccccc1C(=O)Nc1nncs1)c1ccccc1
InChIInChI=1S/C16H12N4O2S/c21-14(11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)15(22)19-16-20-17-10-23-16/h1-10H,(H,18,21)(H,19,20,22)
InChIKeyWPONSKHNDAEGGR-UHFFFAOYSA-N
MW324.37 g/mol
LogP3.04
Rot. Bonds4

About 2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide

2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide (PubChem CID 2806491) has the molecular formula C16H12N4O2S and a molecular weight of 324.37 g/mol. Its IUPAC name is 2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide
PubChem CID2806491
Molecular FormulaC16H12N4O2S
Molecular Weight324.37 g/mol
Exact Mass324.07
IUPAC Name2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide
SMILESO=C(Nc1ccccc1C(=O)Nc1nncs1)c1ccccc1
InChIInChI=1S/C16H12N4O2S/c21-14(11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)15(22)19-16-20-17-10-23-16/h1-10H,(H,18,21)(H,19,20,22)
InChIKeyWPONSKHNDAEGGR-UHFFFAOYSA-N
XLogP3.04
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.37
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 17018933
2-benzamido-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 35935216
2-benzamidobenzamide
CID 702115
3-phenoxy-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 6470444
2-benzamido-N-(5-nitroso-1,3-thiazol-2-yl)benzamide
CID 166872710
2-[(4-bromophenyl)sulfonylamino]-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 2336813
2-benzamido-N-pyridin-4-ylbenzamide
CID 730926
4-[(2-phenylacetyl)amino]-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 17119526
N-[4-[2-oxo-2-(1,3,4-thiadiazol-2-ylamino)ethyl]-1,3-thiazol-2-yl]benzamide
CID 29370806
N-(1,3,4-thiadiazol-2-yl)-1H-pyrrole-3-carboxamide
CID 130649691
1-oxido-N-(1,3,4-thiadiazol-2-yl)pyridin-1-ium-4-carboxamide
CID 29369768
2-benzamido-N-(4-phenylphenyl)benzamide
CID 5224038

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide?
The IUPAC name of 2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide (CID 2806491) is 2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide.
What is the SMILES notation for 2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide?
The canonical SMILES for 2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide is O=C(Nc1ccccc1C(=O)Nc1nncs1)c1ccccc1.
What is the InChIKey of 2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide?
The InChIKey is WPONSKHNDAEGGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4O2S/c21-14(11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)15(22)19-16-20-17-10-23-16/h1-10H,(H,18,21)(H,19,20,22).
What are the key properties of 2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide?
2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide has a molecular weight of 324.37 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-(1,3,4-thiadiazol-2-yl)benzamide is sourced from PubChem (CID 2806491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).