N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide

C15H10ClFN2OS2 — CID 7597170

IUPACN-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1nc(-c2ccc(Cl)s2)cs1
InChIInChI=1S/C15H10ClFN2OS2/c16-13-6-5-12(22-13)11-8-21-15(18-11)19-14(20)7-9-1-3-10(17)4-2-9/h1-6,8H,7H2,(H,18,19,20)
InChIKeyCURCWDFUQLIEGP-UHFFFAOYSA-N
MW352.84 g/mol
LogP4.85
Rot. Bonds4

About N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide

N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide (PubChem CID 7597170) has the molecular formula C15H10ClFN2OS2 and a molecular weight of 352.84 g/mol. Its IUPAC name is N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide
PubChem CID7597170
Molecular FormulaC15H10ClFN2OS2
Molecular Weight352.84 g/mol
Exact Mass351.99
IUPAC NameN-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1nc(-c2ccc(Cl)s2)cs1
InChIInChI=1S/C15H10ClFN2OS2/c16-13-6-5-12(22-13)11-8-21-15(18-11)19-14(20)7-9-1-3-10(17)4-2-9/h1-6,8H,7H2,(H,18,19,20)
InChIKeyCURCWDFUQLIEGP-UHFFFAOYSA-N
XLogP4.85
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.84
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide (CID 7597170) is N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide is O=C(Cc1ccc(F)cc1)Nc1nc(-c2ccc(Cl)s2)cs1.
What is the InChIKey of N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide?
The InChIKey is CURCWDFUQLIEGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClFN2OS2/c16-13-6-5-12(22-13)11-8-21-15(18-11)19-14(20)7-9-1-3-10(17)4-2-9/h1-6,8H,7H2,(H,18,19,20).
What are the key properties of N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide?
N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide has a molecular weight of 352.84 g/mol, XLogP of 4.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 7597170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).