1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide

C19H14F2N4O2S — CID 122285712

IUPAC1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
SMILESO=S(=O)(Cc1cc(F)ccc1F)Nc1ccc(-c2cn3cccnc3n2)cc1
InChIInChI=1S/C19H14F2N4O2S/c20-15-4-7-17(21)14(10-15)12-28(26,27)24-16-5-2-13(3-6-16)18-11-25-9-1-8-22-19(25)23-18/h1-11,24H,12H2
InChIKeyKPWXQZQBGKNBTQ-UHFFFAOYSA-N
MW400.41 g/mol
LogP3.62
Rot. Bonds5

About 1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide

1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide (PubChem CID 122285712) has the molecular formula C19H14F2N4O2S and a molecular weight of 400.41 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
PubChem CID122285712
Molecular FormulaC19H14F2N4O2S
Molecular Weight400.41 g/mol
Exact Mass400.08
IUPAC Name1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
SMILESO=S(=O)(Cc1cc(F)ccc1F)Nc1ccc(-c2cn3cccnc3n2)cc1
InChIInChI=1S/C19H14F2N4O2S/c20-15-4-7-17(21)14(10-15)12-28(26,27)24-16-5-2-13(3-6-16)18-11-25-9-1-8-22-19(25)23-18/h1-11,24H,12H2
InChIKeyKPWXQZQBGKNBTQ-UHFFFAOYSA-N
XLogP3.62
TPSA76.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.41
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-fluorophenyl)-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
CID 122285217
1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
CID 122285748
1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)methanesulfonamide
CID 122285383
1-(2,5-difluorophenyl)-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]methanesulfonamide
CID 122286474
2-(2,6-dioxopiperidin-1-yl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)ethanesulfonamide
CID 122285690
2,6-difluoro-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzenesulfonamide
CID 122285192
1-(2,5-difluorophenyl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)methanesulfonamide
CID 121149684
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzenesulfonamide
CID 121028727
3-chloro-4-fluoro-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzenesulfonamide
CID 122285186
1-(3,4-difluorophenyl)-3-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)urea
CID 122285057
1-(4-fluorophenyl)-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanesulfonamide
CID 122284552
4-fluoro-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzenesulfonamide
CID 22581302

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide?
The IUPAC name of 1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide (CID 122285712) is 1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide.
What is the SMILES notation for 1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide?
The canonical SMILES for 1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide is O=S(=O)(Cc1cc(F)ccc1F)Nc1ccc(-c2cn3cccnc3n2)cc1.
What is the InChIKey of 1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide?
The InChIKey is KPWXQZQBGKNBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N4O2S/c20-15-4-7-17(21)14(10-15)12-28(26,27)24-16-5-2-13(3-6-16)18-11-25-9-1-8-22-19(25)23-18/h1-11,24H,12H2.
What are the key properties of 1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide?
1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide has a molecular weight of 400.41 g/mol, XLogP of 3.62, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide is sourced from PubChem (CID 122285712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).