N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide

C19H15ClN4OS — CID 57391311

IUPACN-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide
SMILESCC(C(=O)Nc1ccc(Cl)cc1)n1c(-c2nccs2)nc2ccccc21
InChIInChI=1S/C19H15ClN4OS/c1-12(18(25)22-14-8-6-13(20)7-9-14)24-16-5-3-2-4-15(16)23-17(24)19-21-10-11-26-19/h2-12H,1H3,(H,22,25)
InChIKeyRWPNFSGNIVOHFV-UHFFFAOYSA-N
MW382.88 g/mol
LogP5.01
Rot. Bonds4

About N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide

N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide (PubChem CID 57391311) has the molecular formula C19H15ClN4OS and a molecular weight of 382.88 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide
PubChem CID57391311
Molecular FormulaC19H15ClN4OS
Molecular Weight382.88 g/mol
Exact Mass382.07
IUPAC NameN-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide
SMILESCC(C(=O)Nc1ccc(Cl)cc1)n1c(-c2nccs2)nc2ccccc21
InChIInChI=1S/C19H15ClN4OS/c1-12(18(25)22-14-8-6-13(20)7-9-14)24-16-5-3-2-4-15(16)23-17(24)19-21-10-11-26-19/h2-12H,1H3,(H,22,25)
InChIKeyRWPNFSGNIVOHFV-UHFFFAOYSA-N
XLogP5.01
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.88
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-Bromophenyl)-2-[2-(1,3-Thiazol-2-Yl)-1h-Benzimidazol-1-Yl]acetamide
CID 44602364
N-(4-Chlorophenyl)-2-[2-(1,3-thiazol-5-yl)-1H-benzimidazol-1-yl]acetamide
CID 612046
N-Phenethyl-2-(2-thiazol-5-yl-benzoimidazol-1-yl)-acetamide
CID 611858
N-(4-Chloro-phenyl)-2-(2-thiazol-4-yl-benzoimidazol-1-yl)-acetamide
CID 1139867
N-(4-Chlorophenyl)-2-(2-(thiophen-2-yl)-1H-benzo[d]imidazol-1-yl)acetamide
CID 17033372
N-(4-fluorophenyl)-2-(2-thiazol-4-ylbenzimidazol-1-yl)acetamide
CID 24513606
N-(3-chlorophenyl)-2-(2-thiazol-4-ylbenzimidazol-1-yl)acetamide
CID 24513641
N-(4-methylsulfanylphenyl)-2-(2-thiazol-4-ylbenzimidazol-1-yl)acetamide
CID 24517453
N-(4-chlorophenyl)-2-(2-thiazol-2-ylbenzimidazol-1-yl)acetamide
CID 45257352
N-(4-chloro-3-cyano-phenyl)-2-(2-thiazol-4-ylbenzimidazol-1-yl)acetamide
CID 57393086
N-(4-chlorophenyl)-2-(2-thiazol-4-ylbenzimidazol-1-yl)propanamide
CID 57394813
N-(3,4-dichlorophenyl)-2-(2-thiazol-2-ylbenzimidazol-1-yl)acetamide
CID 57403530

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide?
The IUPAC name of N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide (CID 57391311) is N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide is CC(C(=O)Nc1ccc(Cl)cc1)n1c(-c2nccs2)nc2ccccc21.
What is the InChIKey of N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide?
The InChIKey is RWPNFSGNIVOHFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN4OS/c1-12(18(25)22-14-8-6-13(20)7-9-14)24-16-5-3-2-4-15(16)23-17(24)19-21-10-11-26-19/h2-12H,1H3,(H,22,25).
What are the key properties of N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide?
N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide has a molecular weight of 382.88 g/mol, XLogP of 5.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[2-(1,3-thiazol-2-yl)benzimidazol-1-yl]propanamide is sourced from PubChem (CID 57391311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).