N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide

C8H6N4O2S2 — CID 47350440

IUPACN-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide
SMILESCC(=O)c1csc(NC(=O)c2cnns2)n1
InChIInChI=1S/C8H6N4O2S2/c1-4(13)5-3-15-8(10-5)11-7(14)6-2-9-12-16-6/h2-3H,1H3,(H,10,11,14)
InChIKeyBSLKRCSAHDESRN-UHFFFAOYSA-N
MW254.30 g/mol
LogP1.45
Rot. Bonds3

About N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide

N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide (PubChem CID 47350440) has the molecular formula C8H6N4O2S2 and a molecular weight of 254.30 g/mol. Its IUPAC name is N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide
PubChem CID47350440
Molecular FormulaC8H6N4O2S2
Molecular Weight254.30 g/mol
Exact Mass253.99
IUPAC NameN-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide
SMILESCC(=O)c1csc(NC(=O)c2cnns2)n1
InChIInChI=1S/C8H6N4O2S2/c1-4(13)5-3-15-8(10-5)11-7(14)6-2-9-12-16-6/h2-3H,1H3,(H,10,11,14)
InChIKeyBSLKRCSAHDESRN-UHFFFAOYSA-N
XLogP1.45
TPSA84.84 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[4-(chloromethyl)-1,3-thiazol-2-yl]thiadiazole-5-carboxamide
CID 65215041
4-[2-(thiadiazole-5-carbonylamino)-1,3-thiazol-4-yl]butanoic acid
CID 80655852
N-(4-acetyl-1,3-thiazol-2-yl)-5-ethylthiophene-2-carboxamide
CID 60716873
N-(4-acetyl-1,3-thiazol-2-yl)-4-tert-butylthiadiazole-5-carboxamide
CID 65205330
N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 60716919
3-(4-acetyl-1,3-thiazol-2-yl)-1,1-dimethylurea
CID 79153632
N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-2-carboxamide
CID 26469458
N-(4-acetyl-1,3-thiazol-2-yl)-1,5-dimethylpyrazole-4-carboxamide
CID 60716951
N-(4-acetyl-1,3-thiazol-2-yl)-6-fluoro-1-benzothiophene-2-carboxamide
CID 112723705
N-(4-acetyl-1,3-thiazol-2-yl)-4-propan-2-ylbenzamide
CID 24555772
N-(4-acetyl-1,3-thiazol-2-yl)-5-chloro-1,3,4-thiadiazole-2-carboxamide
CID 80619701
N-[4-(3-aminophenyl)-1,3-thiazol-2-yl]thiadiazole-5-carboxamide
CID 62056845

Frequently Asked Questions

What is the IUPAC name of N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide?
The IUPAC name of N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide (CID 47350440) is N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide.
What is the SMILES notation for N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide?
The canonical SMILES for N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide is CC(=O)c1csc(NC(=O)c2cnns2)n1.
What is the InChIKey of N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide?
The InChIKey is BSLKRCSAHDESRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N4O2S2/c1-4(13)5-3-15-8(10-5)11-7(14)6-2-9-12-16-6/h2-3H,1H3,(H,10,11,14).
What are the key properties of N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide?
N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide has a molecular weight of 254.30 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetyl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide is sourced from PubChem (CID 47350440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).