1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide

C19H15ClN4O2S — CID 122285748

IUPAC1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
SMILESO=S(=O)(Cc1cccc(Cl)c1)Nc1ccc(-c2cn3cccnc3n2)cc1
InChIInChI=1S/C19H15ClN4O2S/c20-16-4-1-3-14(11-16)13-27(25,26)23-17-7-5-15(6-8-17)18-12-24-10-2-9-21-19(24)22-18/h1-12,23H,13H2
InChIKeyLCPXXXIKNRMXOV-UHFFFAOYSA-N
MW398.88 g/mol
LogP3.99
Rot. Bonds5

About 1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide

1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide (PubChem CID 122285748) has the molecular formula C19H15ClN4O2S and a molecular weight of 398.88 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide.

Molecular Properties

Compound Name1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
PubChem CID122285748
Molecular FormulaC19H15ClN4O2S
Molecular Weight398.88 g/mol
Exact Mass398.06
IUPAC Name1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
SMILESO=S(=O)(Cc1cccc(Cl)c1)Nc1ccc(-c2cn3cccnc3n2)cc1
InChIInChI=1S/C19H15ClN4O2S/c20-16-4-1-3-14(11-16)13-27(25,26)23-17-7-5-15(6-8-17)18-12-24-10-2-9-21-19(24)22-18/h1-12,23H,13H2
InChIKeyLCPXXXIKNRMXOV-UHFFFAOYSA-N
XLogP3.99
TPSA76.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.88
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2,5-difluorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
CID 122285712
3-chloro-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methylbenzenesulfonamide
CID 122285699
2-(2,6-dioxopiperidin-1-yl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)ethanesulfonamide
CID 122285690
2,4-dichloro-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-5-methylbenzenesulfonamide
CID 122285702
1-(2-fluorophenyl)-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
CID 122285217
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
[3-(4-imidazo[1,2-a]pyrimidin-2-ylanilino)phenyl]methanol
CID 121335722
1-(4-fluorophenyl)-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)methanesulfonamide
CID 122285383
5-chloro-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-methoxy-4-methylbenzenesulfonamide
CID 6494020
(E)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-(4-methylphenyl)ethenesulfonamide
CID 122285710
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-propylpentanamide
CID 20868684

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide?
The IUPAC name of 1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide (CID 122285748) is 1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide.
What is the SMILES notation for 1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide?
The canonical SMILES for 1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide is O=S(=O)(Cc1cccc(Cl)c1)Nc1ccc(-c2cn3cccnc3n2)cc1.
What is the InChIKey of 1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide?
The InChIKey is LCPXXXIKNRMXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN4O2S/c20-16-4-1-3-14(11-16)13-27(25,26)23-17-7-5-15(6-8-17)18-12-24-10-2-9-21-19(24)22-18/h1-12,23H,13H2.
What are the key properties of 1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide?
1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide has a molecular weight of 398.88 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide is sourced from PubChem (CID 122285748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).