N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide

C19H18N4O3S — CID 122283515

IUPACN-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
SMILESCc1ccc(-c2cn3ccccc3n2)cc1NS(=O)(=O)c1c(C)noc1C
InChIInChI=1S/C19H18N4O3S/c1-12-7-8-15(17-11-23-9-5-4-6-18(23)20-17)10-16(12)22-27(24,25)19-13(2)21-26-14(19)3/h4-11,22H,1-3H3
InChIKeyIQRBEJAMVGUVPN-UHFFFAOYSA-N
MW382.45 g/mol
LogP3.72
Rot. Bonds4

About N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide

N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide (PubChem CID 122283515) has the molecular formula C19H18N4O3S and a molecular weight of 382.45 g/mol. Its IUPAC name is N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide.

Molecular Properties

Compound NameN-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
PubChem CID122283515
Molecular FormulaC19H18N4O3S
Molecular Weight382.45 g/mol
Exact Mass382.11
IUPAC NameN-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
SMILESCc1ccc(-c2cn3ccccc3n2)cc1NS(=O)(=O)c1c(C)noc1C
InChIInChI=1S/C19H18N4O3S/c1-12-7-8-15(17-11-23-9-5-4-6-18(23)20-17)10-16(12)22-27(24,25)19-13(2)21-26-14(19)3/h4-11,22H,1-3H3
InChIKeyIQRBEJAMVGUVPN-UHFFFAOYSA-N
XLogP3.72
TPSA89.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.45
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
The IUPAC name of N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide (CID 122283515) is N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide.
What is the SMILES notation for N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
The canonical SMILES for N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide is Cc1ccc(-c2cn3ccccc3n2)cc1NS(=O)(=O)c1c(C)noc1C.
What is the InChIKey of N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
The InChIKey is IQRBEJAMVGUVPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3S/c1-12-7-8-15(17-11-23-9-5-4-6-18(23)20-17)10-16(12)22-27(24,25)19-13(2)21-26-14(19)3/h4-11,22H,1-3H3.
What are the key properties of N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide has a molecular weight of 382.45 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide is sourced from PubChem (CID 122283515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).