[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone

C19H19ClN4O3S — CID 26202304

IUPAC[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCc1cccc2nc(C(=O)N3CCN(S(=O)(=O)c4ccc(Cl)cc4)CC3)cn12
InChIInChI=1S/C19H19ClN4O3S/c1-14-3-2-4-18-21-17(13-24(14)18)19(25)22-9-11-23(12-10-22)28(26,27)16-7-5-15(20)6-8-16/h2-8,13H,9-12H2,1H3
InChIKeyOACOUZQSJHDZLQ-UHFFFAOYSA-N
MW418.91 g/mol
LogP2.44
Rot. Bonds3

About [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone

[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone (PubChem CID 26202304) has the molecular formula C19H19ClN4O3S and a molecular weight of 418.91 g/mol. Its IUPAC name is [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone.

Molecular Properties

Compound Name[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone
PubChem CID26202304
Molecular FormulaC19H19ClN4O3S
Molecular Weight418.91 g/mol
Exact Mass418.09
IUPAC Name[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCc1cccc2nc(C(=O)N3CCN(S(=O)(=O)c4ccc(Cl)cc4)CC3)cn12
InChIInChI=1S/C19H19ClN4O3S/c1-14-3-2-4-18-21-17(13-24(14)18)19(25)22-9-11-23(12-10-22)28(26,27)16-7-5-15(20)6-8-16/h2-8,13H,9-12H2,1H3
InChIKeyOACOUZQSJHDZLQ-UHFFFAOYSA-N
XLogP2.44
TPSA74.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.91
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[4-(5-methylimidazo[1,2-a]pyridine-2-carbonyl)piperazin-1-yl]sulfonyl-1,4-dihydroquinoxaline-2,3-dione
CID 25325089
5-methyl-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 55395152
[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-naphthalen-1-ylmethanone
CID 1072073
5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 55382516
5-methyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 55332921
imidazo[1,2-a]pyridin-2-yl-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methanone
CID 26765089
[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanone
CID 27669252
(5-methylimidazo[1,2-a]pyridin-2-yl)-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
CID 56795662
[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-[3-(dimethylamino)phenyl]methanone
CID 7408927
1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-methylpropan-1-one
CID 26202318
N-[3-[4-(4-chlorophenyl)sulfonylpiperazine-1-carbonyl]phenyl]acetamide
CID 17391677
4-(5-methylimidazo[1,2-a]pyridine-2-carbonyl)-1,4-diazepan-2-one
CID 62897584

Frequently Asked Questions

What is the IUPAC name of [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The IUPAC name of [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone (CID 26202304) is [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone.
What is the SMILES notation for [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The canonical SMILES for [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone is Cc1cccc2nc(C(=O)N3CCN(S(=O)(=O)c4ccc(Cl)cc4)CC3)cn12.
What is the InChIKey of [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The InChIKey is OACOUZQSJHDZLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4O3S/c1-14-3-2-4-18-21-17(13-24(14)18)19(25)22-9-11-23(12-10-22)28(26,27)16-7-5-15(20)6-8-16/h2-8,13H,9-12H2,1H3.
What are the key properties of [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone?
[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone has a molecular weight of 418.91 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone is sourced from PubChem (CID 26202304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).