N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide

C15H10ClN3OS — CID 100745439

IUPACN-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1snnc1-c1ccccc1
InChIInChI=1S/C15H10ClN3OS/c16-11-8-4-5-9-12(11)17-15(20)14-13(18-19-21-14)10-6-2-1-3-7-10/h1-9H,(H,17,20)
InChIKeyBOMUSTDRSPLCND-UHFFFAOYSA-N
MW315.79 g/mol
LogP4.11
Rot. Bonds3

About N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide

N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide (PubChem CID 100745439) has the molecular formula C15H10ClN3OS and a molecular weight of 315.79 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide
PubChem CID100745439
Molecular FormulaC15H10ClN3OS
Molecular Weight315.79 g/mol
Exact Mass315.02
IUPAC NameN-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1snnc1-c1ccccc1
InChIInChI=1S/C15H10ClN3OS/c16-11-8-4-5-9-12(11)17-15(20)14-13(18-19-21-14)10-6-2-1-3-7-10/h1-9H,(H,17,20)
InChIKeyBOMUSTDRSPLCND-UHFFFAOYSA-N
XLogP4.11
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.79
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide 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

N-(2-bromophenyl)-4-phenylthiadiazole-5-carboxamide
CID 100745447
N-(3,5-dichlorophenyl)-4-phenylthiadiazole-5-carboxamide
CID 2767937
N-(4-chlorophenyl)-4-phenylthiadiazole-5-carboxamide
CID 2767935
N-(2-bromophenyl)-4-(4-fluorophenyl)thiadiazole-5-carboxamide
CID 100749567
4-(4-fluorophenyl)-N-(2-phenoxyphenyl)thiadiazole-5-carboxamide
CID 100750257
methyl 2-[[4-(4-methylphenyl)thiadiazole-5-carbonyl]amino]benzoate
CID 100748907
N-(2-methoxyphenyl)-4-(3-methoxyphenyl)thiadiazole-5-carboxamide
CID 100747133
N-[4-[(5-chloro-2-methoxyphenyl)carbamothioylamino]phenyl]-4-phenylthiadiazole-5-carboxamide
CID 141023427
N-(2-chlorophenyl)-4,6-diphenylpyrimidine-2-carboxamide
CID 4245690
N-benzhydryl-4-(4-methylphenyl)thiadiazole-5-carboxamide
CID 100749195
N-(2-bromo-3-chlorophenyl)-4-methylthiadiazole-5-carboxamide
CID 103479705
N-(2-fluorophenyl)-4-thiophen-2-ylthiadiazole-5-carboxamide
CID 100751885

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide (CID 100745439) is N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide is O=C(Nc1ccccc1Cl)c1snnc1-c1ccccc1.
What is the InChIKey of N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide?
The InChIKey is BOMUSTDRSPLCND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3OS/c16-11-8-4-5-9-12(11)17-15(20)14-13(18-19-21-14)10-6-2-1-3-7-10/h1-9H,(H,17,20).
What are the key properties of N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide?
N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide has a molecular weight of 315.79 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-4-phenylthiadiazole-5-carboxamide is sourced from PubChem (CID 100745439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).